################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chem_shift_list_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_1 _Assigned_chem_shift_list.Entry_ID 16521 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '2D 1H-15N HSQC' . . . 16521 1 2 '2D 1H-13C HSQC' . . . 16521 1 stop_ loop_ _Chem_shift_software.Software_ID _Chem_shift_software.Software_label _Chem_shift_software.Method_ID _Chem_shift_software.Method_label _Chem_shift_software.Entry_ID _Chem_shift_software.Assigned_chem_shift_list_ID 7 $SPARKY . . 16521 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 1 1 MET HA H 1 4.46 0.02 . 1 . . . . 1 MET HA . 16521 1 2 . 1 1 1 1 MET HB2 H 1 2.11 0.02 . 2 . . . . 1 MET HB2 . 16521 1 3 . 1 1 1 1 MET HB3 H 1 1.89 0.02 . 2 . . . . 1 MET HB3 . 16521 1 4 . 1 1 1 1 MET HE1 H 1 2.11 0.02 . 1 . . . . 1 MET HE . 16521 1 5 . 1 1 1 1 MET HE2 H 1 2.11 0.02 . 1 . . . . 1 MET HE . 16521 1 6 . 1 1 1 1 MET HE3 H 1 2.11 0.02 . 1 . . . . 1 MET HE . 16521 1 7 . 1 1 1 1 MET HG2 H 1 2.66 0.02 . 2 . . . . 1 MET HG2 . 16521 1 8 . 1 1 1 1 MET HG3 H 1 2.56 0.02 . 2 . . . . 1 MET HG3 . 16521 1 9 . 1 1 1 1 MET C C 13 175.6 0.2 . 1 . . . . 1 MET C . 16521 1 10 . 1 1 1 1 MET CA C 13 55.8 0.2 . 1 . . . . 1 MET CA . 16521 1 11 . 1 1 1 1 MET CB C 13 33.9 0.2 . 1 . . . . 1 MET CB . 16521 1 12 . 1 1 1 1 MET CE C 13 17.2 0.2 . 1 . . . . 1 MET CE . 16521 1 13 . 1 1 1 1 MET CG C 13 32.3 0.2 . 1 . . . . 1 MET CG . 16521 1 14 . 1 1 2 2 ASN H H 1 8.53 0.02 . 1 . . . . 2 ASN H . 16521 1 15 . 1 1 2 2 ASN HA H 1 4.73 0.02 . 1 . . . . 2 ASN HA . 16521 1 16 . 1 1 2 2 ASN HB2 H 1 2.86 0.02 . 2 . . . . 2 ASN HB2 . 16521 1 17 . 1 1 2 2 ASN HB3 H 1 2.73 0.02 . 2 . . . . 2 ASN HB3 . 16521 1 18 . 1 1 2 2 ASN HD21 H 1 7.71 0.02 . 2 . . . . 2 ASN HD21 . 16521 1 19 . 1 1 2 2 ASN HD22 H 1 7 0.02 . 2 . . . . 2 ASN HD22 . 16521 1 20 . 1 1 2 2 ASN C C 13 174.7 0.2 . 1 . . . . 2 ASN C . 16521 1 21 . 1 1 2 2 ASN CA C 13 53.1 0.2 . 1 . . . . 2 ASN CA . 16521 1 22 . 1 1 2 2 ASN CB C 13 39.1 0.2 . 1 . . . . 2 ASN CB . 16521 1 23 . 1 1 2 2 ASN CG C 13 177.1 0.2 . 1 . . . . 2 ASN CG . 16521 1 24 . 1 1 2 2 ASN N N 15 119.9 0.2 . 1 . . . . 2 ASN N . 16521 1 25 . 1 1 2 2 ASN ND2 N 15 113.3 0.2 . 1 . . . . 2 ASN ND2 . 16521 1 26 . 1 1 3 3 VAL H H 1 7.89 0.02 . 1 . . . . 3 VAL H . 16521 1 27 . 1 1 3 3 VAL HA H 1 4.4 0.02 . 1 . . . . 3 VAL HA . 16521 1 28 . 1 1 3 3 VAL HB H 1 1.95 0.02 . 1 . . . . 3 VAL HB . 16521 1 29 . 1 1 3 3 VAL HG11 H 1 0.86 0.02 . 1 . . . . 3 VAL HG1 . 16521 1 30 . 1 1 3 3 VAL HG12 H 1 0.86 0.02 . 1 . . . . 3 VAL HG1 . 16521 1 31 . 1 1 3 3 VAL HG13 H 1 0.86 0.02 . 1 . . . . 3 VAL HG1 . 16521 1 32 . 1 1 3 3 VAL HG21 H 1 0.89 0.02 . 1 . . . . 3 VAL HG2 . 16521 1 33 . 1 1 3 3 VAL HG22 H 1 0.89 0.02 . 1 . . . . 3 VAL HG2 . 16521 1 34 . 1 1 3 3 VAL HG23 H 1 0.89 0.02 . 1 . . . . 3 VAL HG2 . 16521 1 35 . 1 1 3 3 VAL C C 13 175.2 0.2 . 1 . . . . 3 VAL C . 16521 1 36 . 1 1 3 3 VAL CA C 13 62.0 0.2 . 1 . . . . 3 VAL CA . 16521 1 37 . 1 1 3 3 VAL CB C 13 33.1 0.2 . 1 . . . . 3 VAL CB . 16521 1 38 . 1 1 3 3 VAL CG1 C 13 21.4 0.2 . 1 . . . . 3 VAL CG1 . 16521 1 39 . 1 1 3 3 VAL CG2 C 13 20.4 0.2 . 1 . . . . 3 VAL CG2 . 16521 1 40 . 1 1 3 3 VAL N N 15 116.5 0.2 . 1 . . . . 3 VAL N . 16521 1 41 . 1 1 4 4 ALA H H 1 8.77 0.02 . 1 . . . . 4 ALA H . 16521 1 42 . 1 1 4 4 ALA HA H 1 4.79 0.02 . 1 . . . . 4 ALA HA . 16521 1 43 . 1 1 4 4 ALA HB1 H 1 1.36 0.02 . 1 . . . . 4 ALA HB . 16521 1 44 . 1 1 4 4 ALA HB2 H 1 1.36 0.02 . 1 . . . . 4 ALA HB . 16521 1 45 . 1 1 4 4 ALA HB3 H 1 1.36 0.02 . 1 . . . . 4 ALA HB . 16521 1 46 . 1 1 4 4 ALA C C 13 176 0.2 . 1 . . . . 4 ALA C . 16521 1 47 . 1 1 4 4 ALA CA C 13 50.5 0.2 . 1 . . . . 4 ALA CA . 16521 1 48 . 1 1 4 4 ALA CB C 13 21.5 0.2 . 1 . . . . 4 ALA CB . 16521 1 49 . 1 1 4 4 ALA N N 15 127.1 0.2 . 1 . . . . 4 ALA N . 16521 1 50 . 1 1 5 5 HIS H H 1 8.78 0.02 . 1 . . . . 5 HIS H . 16521 1 51 . 1 1 5 5 HIS HA H 1 5.38 0.02 . 1 . . . . 5 HIS HA . 16521 1 52 . 1 1 5 5 HIS HB2 H 1 3.11 0.02 . 2 . . . . 5 HIS HB2 . 16521 1 53 . 1 1 5 5 HIS HB3 H 1 3.05 0.02 . 2 . . . . 5 HIS HB3 . 16521 1 54 . 1 1 5 5 HIS HD2 H 1 6.78 0.02 . 1 . . . . 5 HIS HD2 . 16521 1 55 . 1 1 5 5 HIS HE1 H 1 7.74 0.02 . 1 . . . . 5 HIS HE1 . 16521 1 56 . 1 1 5 5 HIS C C 13 175.7 0.2 . 1 . . . . 5 HIS C . 16521 1 57 . 1 1 5 5 HIS CA C 13 55.7 0.2 . 1 . . . . 5 HIS CA . 16521 1 58 . 1 1 5 5 HIS CB C 13 31.8 0.2 . 1 . . . . 5 HIS CB . 16521 1 59 . 1 1 5 5 HIS CD2 C 13 118.4 0.2 . 1 . . . . 5 HIS CD2 . 16521 1 60 . 1 1 5 5 HIS CE1 C 13 138.2 0.2 . 1 . . . . 5 HIS CE1 . 16521 1 61 . 1 1 5 5 HIS N N 15 121.2 0.2 . 1 . . . . 5 HIS N . 16521 1 62 . 1 1 5 5 HIS ND1 N 15 220.8 0.2 . 1 . . . . 5 HIS ND1 . 16521 1 63 . 1 1 5 5 HIS NE2 N 15 185.2 0.2 . 1 . . . . 5 HIS NE2 . 16521 1 64 . 1 1 6 6 TYR H H 1 9.39 0.02 . 1 . . . . 6 TYR H . 16521 1 65 . 1 1 6 6 TYR HA H 1 4.74 0.02 . 1 . . . . 6 TYR HA . 16521 1 66 . 1 1 6 6 TYR HB2 H 1 2.78 0.02 . 2 . . . . 6 TYR HB2 . 16521 1 67 . 1 1 6 6 TYR HB3 H 1 2.68 0.02 . 2 . . . . 6 TYR HB3 . 16521 1 68 . 1 1 6 6 TYR HD1 H 1 7.03 0.02 . 3 . . . . 6 TYR HD1 . 16521 1 69 . 1 1 6 6 TYR HD2 H 1 7.03 0.02 . 3 . . . . 6 TYR HD2 . 16521 1 70 . 1 1 6 6 TYR HE1 H 1 6.73 0.02 . 3 . . . . 6 TYR HE1 . 16521 1 71 . 1 1 6 6 TYR HE2 H 1 6.73 0.02 . 3 . . . . 6 TYR HE2 . 16521 1 72 . 1 1 6 6 TYR C C 13 173.6 0.2 . 1 . . . . 6 TYR C . 16521 1 73 . 1 1 6 6 TYR CA C 13 58.4 0.2 . 1 . . . . 6 TYR CA . 16521 1 74 . 1 1 6 6 TYR CB C 13 41.4 0.2 . 1 . . . . 6 TYR CB . 16521 1 75 . 1 1 6 6 TYR CD1 C 13 133.5 0.2 . 3 . . . . 6 TYR CD1 . 16521 1 76 . 1 1 6 6 TYR CD2 C 13 133.5 0.2 . 3 . . . . 6 TYR CD2 . 16521 1 77 . 1 1 6 6 TYR CE1 C 13 118.9 0.2 . 3 . . . . 6 TYR CE1 . 16521 1 78 . 1 1 6 6 TYR CE2 C 13 118.9 0.2 . 3 . . . . 6 TYR CE2 . 16521 1 79 . 1 1 6 6 TYR N N 15 126.5 0.2 . 1 . . . . 6 TYR N . 16521 1 80 . 1 1 7 7 ARG H H 1 9.05 0.02 . 1 . . . . 7 ARG H . 16521 1 81 . 1 1 7 7 ARG HA H 1 3.63 0.02 . 1 . . . . 7 ARG HA . 16521 1 82 . 1 1 7 7 ARG HB2 H 1 1.94 0.02 . 2 . . . . 7 ARG HB2 . 16521 1 83 . 1 1 7 7 ARG HB3 H 1 1.35 0.02 . 2 . . . . 7 ARG HB3 . 16521 1 84 . 1 1 7 7 ARG HD2 H 1 3.05 0.02 . 2 . . . . 7 ARG HD2 . 16521 1 85 . 1 1 7 7 ARG HD3 H 1 2.55 0.02 . 2 . . . . 7 ARG HD3 . 16521 1 86 . 1 1 7 7 ARG HE H 1 6.94 0.02 . 1 . . . . 7 ARG HE . 16521 1 87 . 1 1 7 7 ARG HG2 H 1 0.97 0.02 . 2 . . . . 7 ARG HG2 . 16521 1 88 . 1 1 7 7 ARG HG3 H 1 -0.09 0.02 . 2 . . . . 7 ARG HG3 . 16521 1 89 . 1 1 7 7 ARG C C 13 174.8 0.2 . 1 . . . . 7 ARG C . 16521 1 90 . 1 1 7 7 ARG CA C 13 58 0.2 . 1 . . . . 7 ARG CA . 16521 1 91 . 1 1 7 7 ARG CB C 13 28.9 0.2 . 1 . . . . 7 ARG CB . 16521 1 92 . 1 1 7 7 ARG CD C 13 44.2 0.2 . 1 . . . . 7 ARG CD . 16521 1 93 . 1 1 7 7 ARG CG C 13 25.9 0.2 . 1 . . . . 7 ARG CG . 16521 1 94 . 1 1 7 7 ARG N N 15 123.9 0.2 . 1 . . . . 7 ARG N . 16521 1 95 . 1 1 7 7 ARG NE N 15 84.9 0.2 . 1 . . . . 7 ARG NE . 16521 1 96 . 1 1 8 8 GLY H H 1 8.37 0.02 . 1 . . . . 8 GLY H . 16521 1 97 . 1 1 8 8 GLY HA2 H 1 4.09 0.02 . 2 . . . . 8 GLY HA2 . 16521 1 98 . 1 1 8 8 GLY HA3 H 1 3.46 0.02 . 2 . . . . 8 GLY HA3 . 16521 1 99 . 1 1 8 8 GLY C C 13 173.8 0.2 . 1 . . . . 8 GLY C . 16521 1 100 . 1 1 8 8 GLY CA C 13 44.9 0.2 . 1 . . . . 8 GLY CA . 16521 1 101 . 1 1 8 8 GLY N N 15 102.1 0.2 . 1 . . . . 8 GLY N . 16521 1 102 . 1 1 9 9 TYR H H 1 8.34 0.02 . 1 . . . . 9 TYR H . 16521 1 103 . 1 1 9 9 TYR HA H 1 4.86 0.02 . 1 . . . . 9 TYR HA . 16521 1 104 . 1 1 9 9 TYR HB2 H 1 3.11 0.02 . 2 . . . . 9 TYR HB2 . 16521 1 105 . 1 1 9 9 TYR HB3 H 1 2.91 0.02 . 2 . . . . 9 TYR HB3 . 16521 1 106 . 1 1 9 9 TYR HD1 H 1 6.96 0.02 . 3 . . . . 9 TYR HD1 . 16521 1 107 . 1 1 9 9 TYR HD2 H 1 6.96 0.02 . 3 . . . . 9 TYR HD2 . 16521 1 108 . 1 1 9 9 TYR HE1 H 1 6.74 0.02 . 3 . . . . 9 TYR HE1 . 16521 1 109 . 1 1 9 9 TYR HE2 H 1 6.74 0.02 . 3 . . . . 9 TYR HE2 . 16521 1 110 . 1 1 9 9 TYR C C 13 173.8 0.2 . 1 . . . . 9 TYR C . 16521 1 111 . 1 1 9 9 TYR CA C 13 57.7 0.2 . 1 . . . . 9 TYR CA . 16521 1 112 . 1 1 9 9 TYR CB C 13 40.5 0.2 . 1 . . . . 9 TYR CB . 16521 1 113 . 1 1 9 9 TYR CD1 C 13 134 0.2 . 3 . . . . 9 TYR CD1 . 16521 1 114 . 1 1 9 9 TYR CD2 C 13 134 0.2 . 3 . . . . 9 TYR CD2 . 16521 1 115 . 1 1 9 9 TYR CE1 C 13 116.9 0.2 . 3 . . . . 9 TYR CE1 . 16521 1 116 . 1 1 9 9 TYR CE2 C 13 116.9 0.2 . 3 . . . . 9 TYR CE2 . 16521 1 117 . 1 1 9 9 TYR N N 15 119.9 0.2 . 1 . . . . 9 TYR N . 16521 1 118 . 1 1 10 10 GLU H H 1 9.52 0.02 . 1 . . . . 10 GLU H . 16521 1 119 . 1 1 10 10 GLU HA H 1 4.85 0.02 . 1 . . . . 10 GLU HA . 16521 1 120 . 1 1 10 10 GLU HB2 H 1 1.82 0.02 . 2 . . . . 10 GLU HB2 . 16521 1 121 . 1 1 10 10 GLU HB3 H 1 1.72 0.02 . 2 . . . . 10 GLU HB3 . 16521 1 122 . 1 1 10 10 GLU HG2 H 1 1.97 0.02 . 2 . . . . 10 GLU HG2 . 16521 1 123 . 1 1 10 10 GLU HG3 H 1 1.82 0.02 . 2 . . . . 10 GLU HG3 . 16521 1 124 . 1 1 10 10 GLU C C 13 174.8 0.2 . 1 . . . . 10 GLU C . 16521 1 125 . 1 1 10 10 GLU CA C 13 54.7 0.2 . 1 . . . . 10 GLU CA . 16521 1 126 . 1 1 10 10 GLU CB C 13 32.9 0.2 . 1 . . . . 10 GLU CB . 16521 1 127 . 1 1 10 10 GLU CG C 13 37.6 0.2 . 1 . . . . 10 GLU CG . 16521 1 128 . 1 1 10 10 GLU N N 15 122.1 0.2 . 1 . . . . 10 GLU N . 16521 1 129 . 1 1 11 11 ILE H H 1 9.29 0.02 . 1 . . . . 11 ILE H . 16521 1 130 . 1 1 11 11 ILE HA H 1 4.57 0.02 . 1 . . . . 11 ILE HA . 16521 1 131 . 1 1 11 11 ILE HB H 1 1.73 0.02 . 1 . . . . 11 ILE HB . 16521 1 132 . 1 1 11 11 ILE HD11 H 1 0.72 0.02 . 1 . . . . 11 ILE HD1 . 16521 1 133 . 1 1 11 11 ILE HD12 H 1 0.72 0.02 . 1 . . . . 11 ILE HD1 . 16521 1 134 . 1 1 11 11 ILE HD13 H 1 0.72 0.02 . 1 . . . . 11 ILE HD1 . 16521 1 135 . 1 1 11 11 ILE HG12 H 1 1.6 0.02 . 2 . . . . 11 ILE HG12 . 16521 1 136 . 1 1 11 11 ILE HG13 H 1 0.63 0.02 . 2 . . . . 11 ILE HG13 . 16521 1 137 . 1 1 11 11 ILE HG21 H 1 0.58 0.02 . 1 . . . . 11 ILE HG2 . 16521 1 138 . 1 1 11 11 ILE HG22 H 1 0.58 0.02 . 1 . . . . 11 ILE HG2 . 16521 1 139 . 1 1 11 11 ILE HG23 H 1 0.58 0.02 . 1 . . . . 11 ILE HG2 . 16521 1 140 . 1 1 11 11 ILE C C 13 174.4 0.2 . 1 . . . . 11 ILE C . 16521 1 141 . 1 1 11 11 ILE CA C 13 59.9 0.2 . 1 . . . . 11 ILE CA . 16521 1 142 . 1 1 11 11 ILE CB C 13 41.1 0.2 . 1 . . . . 11 ILE CB . 16521 1 143 . 1 1 11 11 ILE CD1 C 13 15.4 0.2 . 1 . . . . 11 ILE CD1 . 16521 1 144 . 1 1 11 11 ILE CG1 C 13 27 0.2 . 1 . . . . 11 ILE CG1 . 16521 1 145 . 1 1 11 11 ILE CG2 C 13 18.7 0.2 . 1 . . . . 11 ILE CG2 . 16521 1 146 . 1 1 11 11 ILE N N 15 125.6 0.2 . 1 . . . . 11 ILE N . 16521 1 147 . 1 1 12 12 GLU H H 1 9.5 0.02 . 1 . . . . 12 GLU H . 16521 1 148 . 1 1 12 12 GLU HA H 1 4.99 0.02 . 1 . . . . 12 GLU HA . 16521 1 149 . 1 1 12 12 GLU HB2 H 1 2.15 0.02 . 2 . . . . 12 GLU HB2 . 16521 1 150 . 1 1 12 12 GLU HB3 H 1 1.96 0.02 . 2 . . . . 12 GLU HB3 . 16521 1 151 . 1 1 12 12 GLU HG2 H 1 2.25 0.02 . 2 . . . . 12 GLU HG2 . 16521 1 152 . 1 1 12 12 GLU HG3 H 1 2.14 0.02 . 2 . . . . 12 GLU HG3 . 16521 1 153 . 1 1 12 12 GLU CA C 13 52.3 0.2 . 1 . . . . 12 GLU CA . 16521 1 154 . 1 1 12 12 GLU CB C 13 30.7 0.2 . 1 . . . . 12 GLU CB . 16521 1 155 . 1 1 12 12 GLU CG C 13 35.6 0.2 . 1 . . . . 12 GLU CG . 16521 1 156 . 1 1 12 12 GLU N N 15 130.2 0.2 . 1 . . . . 12 GLU N . 16521 1 157 . 1 1 13 13 PRO HA H 1 4.51 0.02 . 1 . . . . 13 PRO HA . 16521 1 158 . 1 1 13 13 PRO HB2 H 1 2.18 0.02 . 2 . . . . 13 PRO HB2 . 16521 1 159 . 1 1 13 13 PRO HB3 H 1 1.82 0.02 . 2 . . . . 13 PRO HB3 . 16521 1 160 . 1 1 13 13 PRO HD2 H 1 4.23 0.02 . 2 . . . . 13 PRO HD2 . 16521 1 161 . 1 1 13 13 PRO HD3 H 1 3.72 0.02 . 2 . . . . 13 PRO HD3 . 16521 1 162 . 1 1 13 13 PRO HG2 H 1 2 0.02 . 2 . . . . 13 PRO HG2 . 16521 1 163 . 1 1 13 13 PRO HG3 H 1 1.72 0.02 . 2 . . . . 13 PRO HG3 . 16521 1 164 . 1 1 13 13 PRO C C 13 176 0.2 . 1 . . . . 13 PRO C . 16521 1 165 . 1 1 13 13 PRO CA C 13 61.8 0.2 . 1 . . . . 13 PRO CA . 16521 1 166 . 1 1 13 13 PRO CB C 13 33.2 0.2 . 1 . . . . 13 PRO CB . 16521 1 167 . 1 1 13 13 PRO CD C 13 51.9 0.2 . 1 . . . . 13 PRO CD . 16521 1 168 . 1 1 13 13 PRO CG C 13 27.4 0.2 . 1 . . . . 13 PRO CG . 16521 1 169 . 1 1 14 14 GLY H H 1 7.97 0.02 . 1 . . . . 14 GLY H . 16521 1 170 . 1 1 14 14 GLY HA2 H 1 4.4 0.02 . 2 . . . . 14 GLY HA2 . 16521 1 171 . 1 1 14 14 GLY HA3 H 1 4.24 0.02 . 2 . . . . 14 GLY HA3 . 16521 1 172 . 1 1 14 14 GLY C C 13 172.5 0.2 . 1 . . . . 14 GLY C . 16521 1 173 . 1 1 14 14 GLY CA C 13 47 0.2 . 1 . . . . 14 GLY CA . 16521 1 174 . 1 1 14 14 GLY N N 15 107.5 0.2 . 1 . . . . 14 GLY N . 16521 1 175 . 1 1 15 15 HIS H H 1 8.42 0.02 . 1 . . . . 15 HIS H . 16521 1 176 . 1 1 15 15 HIS HA H 1 5.87 0.02 . 1 . . . . 15 HIS HA . 16521 1 177 . 1 1 15 15 HIS HB2 H 1 3.28 0.02 . 2 . . . . 15 HIS HB2 . 16521 1 178 . 1 1 15 15 HIS HB3 H 1 3.07 0.02 . 2 . . . . 15 HIS HB3 . 16521 1 179 . 1 1 15 15 HIS HD2 H 1 6.66 0.02 . 1 . . . . 15 HIS HD2 . 16521 1 180 . 1 1 15 15 HIS HE1 H 1 7.32 0.02 . 1 . . . . 15 HIS HE1 . 16521 1 181 . 1 1 15 15 HIS C C 13 173.9 0.2 . 1 . . . . 15 HIS C . 16521 1 182 . 1 1 15 15 HIS CA C 13 55.6 0.2 . 1 . . . . 15 HIS CA . 16521 1 183 . 1 1 15 15 HIS CB C 13 33.3 0.2 . 1 . . . . 15 HIS CB . 16521 1 184 . 1 1 15 15 HIS CD2 C 13 118.1 0.2 . 1 . . . . 15 HIS CD2 . 16521 1 185 . 1 1 15 15 HIS CE1 C 13 138.5 0.2 . 1 . . . . 15 HIS CE1 . 16521 1 186 . 1 1 15 15 HIS N N 15 113.4 0.2 . 1 . . . . 15 HIS N . 16521 1 187 . 1 1 16 16 GLN H H 1 9.14 0.02 . 1 . . . . 16 GLN H . 16521 1 188 . 1 1 16 16 GLN HA H 1 4.68 0.02 . 1 . . . . 16 GLN HA . 16521 1 189 . 1 1 16 16 GLN HB2 H 1 1.97 0.02 . 2 . . . . 16 GLN HB2 . 16521 1 190 . 1 1 16 16 GLN HB3 H 1 1.77 0.02 . 2 . . . . 16 GLN HB3 . 16521 1 191 . 1 1 16 16 GLN HE21 H 1 6.22 0.02 . 2 . . . . 16 GLN HE21 . 16521 1 192 . 1 1 16 16 GLN HE22 H 1 6.39 0.02 . 2 . . . . 16 GLN HE22 . 16521 1 193 . 1 1 16 16 GLN HG2 H 1 1.95 0.02 . 2 . . . . 16 GLN HG2 . 16521 1 194 . 1 1 16 16 GLN HG3 H 1 1.95 0.02 . 2 . . . . 16 GLN HG3 . 16521 1 195 . 1 1 16 16 GLN C C 13 175 0.2 . 1 . . . . 16 GLN C . 16521 1 196 . 1 1 16 16 GLN CA C 13 55 0.2 . 1 . . . . 16 GLN CA . 16521 1 197 . 1 1 16 16 GLN CB C 13 31.6 0.2 . 1 . . . . 16 GLN CB . 16521 1 198 . 1 1 16 16 GLN CD C 13 179.3 0.2 . 1 . . . . 16 GLN CD . 16521 1 199 . 1 1 16 16 GLN CG C 13 33.6 0.2 . 1 . . . . 16 GLN CG . 16521 1 200 . 1 1 16 16 GLN N N 15 116.7 0.2 . 1 . . . . 16 GLN N . 16521 1 201 . 1 1 16 16 GLN NE2 N 15 110.4 0.2 . 1 . . . . 16 GLN NE2 . 16521 1 202 . 1 1 17 17 TYR H H 1 9.37 0.02 . 1 . . . . 17 TYR H . 16521 1 203 . 1 1 17 17 TYR HA H 1 4.85 0.02 . 1 . . . . 17 TYR HA . 16521 1 204 . 1 1 17 17 TYR HB2 H 1 2.9 0.02 . 2 . . . . 17 TYR HB2 . 16521 1 205 . 1 1 17 17 TYR HB3 H 1 2.9 0.02 . 2 . . . . 17 TYR HB3 . 16521 1 206 . 1 1 17 17 TYR HD1 H 1 6.08 0.02 . 3 . . . . 17 TYR HD1 . 16521 1 207 . 1 1 17 17 TYR HD2 H 1 6.08 0.02 . 3 . . . . 17 TYR HD2 . 16521 1 208 . 1 1 17 17 TYR HE1 H 1 6.32 0.02 . 3 . . . . 17 TYR HE1 . 16521 1 209 . 1 1 17 17 TYR HE2 H 1 6.32 0.02 . 3 . . . . 17 TYR HE2 . 16521 1 210 . 1 1 17 17 TYR C C 13 175.1 0.2 . 1 . . . . 17 TYR C . 16521 1 211 . 1 1 17 17 TYR CA C 13 57.1 0.2 . 1 . . . . 17 TYR CA . 16521 1 212 . 1 1 17 17 TYR CB C 13 40.1 0.2 . 1 . . . . 17 TYR CB . 16521 1 213 . 1 1 17 17 TYR CD1 C 13 133.2 0.2 . 3 . . . . 17 TYR CD1 . 16521 1 214 . 1 1 17 17 TYR CD2 C 13 133.2 0.2 . 3 . . . . 17 TYR CD2 . 16521 1 215 . 1 1 17 17 TYR CE1 C 13 117.2 0.2 . 3 . . . . 17 TYR CE1 . 16521 1 216 . 1 1 17 17 TYR CE2 C 13 117.2 0.2 . 3 . . . . 17 TYR CE2 . 16521 1 217 . 1 1 17 17 TYR N N 15 125.1 0.2 . 1 . . . . 17 TYR N . 16521 1 218 . 1 1 18 18 ARG H H 1 8.4 0.02 . 1 . . . . 18 ARG H . 16521 1 219 . 1 1 18 18 ARG HA H 1 4.39 0.02 . 1 . . . . 18 ARG HA . 16521 1 220 . 1 1 18 18 ARG HB2 H 1 1.87 0.02 . 2 . . . . 18 ARG HB2 . 16521 1 221 . 1 1 18 18 ARG HB3 H 1 1.48 0.02 . 2 . . . . 18 ARG HB3 . 16521 1 222 . 1 1 18 18 ARG HD2 H 1 3.17 0.02 . 2 . . . . 18 ARG HD2 . 16521 1 223 . 1 1 18 18 ARG HD3 H 1 3.08 0.02 . 2 . . . . 18 ARG HD3 . 16521 1 224 . 1 1 18 18 ARG HE H 1 8.27 0.02 . 1 . . . . 18 ARG HE . 16521 1 225 . 1 1 18 18 ARG HG2 H 1 1.55 0.02 . 2 . . . . 18 ARG HG2 . 16521 1 226 . 1 1 18 18 ARG HG3 H 1 1.43 0.02 . 2 . . . . 18 ARG HG3 . 16521 1 227 . 1 1 18 18 ARG C C 13 175.3 0.2 . 1 . . . . 18 ARG C . 16521 1 228 . 1 1 18 18 ARG CA C 13 53.1 0.2 . 1 . . . . 18 ARG CA . 16521 1 229 . 1 1 18 18 ARG CB C 13 29.8 0.2 . 1 . . . . 18 ARG CB . 16521 1 230 . 1 1 18 18 ARG CD C 13 42.1 0.2 . 1 . . . . 18 ARG CD . 16521 1 231 . 1 1 18 18 ARG CG C 13 26.2 0.2 . 1 . . . . 18 ARG CG . 16521 1 232 . 1 1 18 18 ARG N N 15 129.2 0.2 . 1 . . . . 18 ARG N . 16521 1 233 . 1 1 18 18 ARG NE N 15 83.4 0.2 . 1 . . . . 18 ARG NE . 16521 1 234 . 1 1 19 19 ASP H H 1 8.46 0.02 . 1 . . . . 19 ASP H . 16521 1 235 . 1 1 19 19 ASP HA H 1 3.85 0.02 . 1 . . . . 19 ASP HA . 16521 1 236 . 1 1 19 19 ASP HB2 H 1 2.72 0.02 . 2 . . . . 19 ASP HB2 . 16521 1 237 . 1 1 19 19 ASP HB3 H 1 2.59 0.02 . 2 . . . . 19 ASP HB3 . 16521 1 238 . 1 1 19 19 ASP C C 13 175.9 0.2 . 1 . . . . 19 ASP C . 16521 1 239 . 1 1 19 19 ASP CA C 13 56 0.2 . 1 . . . . 19 ASP CA . 16521 1 240 . 1 1 19 19 ASP CB C 13 41.3 0.2 . 1 . . . . 19 ASP CB . 16521 1 241 . 1 1 19 19 ASP N N 15 123.7 0.2 . 1 . . . . 19 ASP N . 16521 1 242 . 1 1 20 20 ASP H H 1 8.84 0.02 . 1 . . . . 20 ASP H . 16521 1 243 . 1 1 20 20 ASP HA H 1 4.21 0.02 . 1 . . . . 20 ASP HA . 16521 1 244 . 1 1 20 20 ASP HB2 H 1 2.8 0.02 . 2 . . . . 20 ASP HB2 . 16521 1 245 . 1 1 20 20 ASP HB3 H 1 2.56 0.02 . 2 . . . . 20 ASP HB3 . 16521 1 246 . 1 1 20 20 ASP C C 13 177.7 0.2 . 1 . . . . 20 ASP C . 16521 1 247 . 1 1 20 20 ASP CA C 13 55.8 0.2 . 1 . . . . 20 ASP CA . 16521 1 248 . 1 1 20 20 ASP CB C 13 38.5 0.2 . 1 . . . . 20 ASP CB . 16521 1 249 . 1 1 20 20 ASP N N 15 116.7 0.2 . 1 . . . . 20 ASP N . 16521 1 250 . 1 1 21 21 ILE H H 1 7.18 0.02 . 1 . . . . 21 ILE H . 16521 1 251 . 1 1 21 21 ILE HA H 1 4.24 0.02 . 1 . . . . 21 ILE HA . 16521 1 252 . 1 1 21 21 ILE HB H 1 1.77 0.02 . 1 . . . . 21 ILE HB . 16521 1 253 . 1 1 21 21 ILE HD11 H 1 0.08 0.02 . 1 . . . . 21 ILE HD1 . 16521 1 254 . 1 1 21 21 ILE HD12 H 1 0.08 0.02 . 1 . . . . 21 ILE HD1 . 16521 1 255 . 1 1 21 21 ILE HD13 H 1 0.08 0.02 . 1 . . . . 21 ILE HD1 . 16521 1 256 . 1 1 21 21 ILE HG12 H 1 0.72 0.02 . 2 . . . . 21 ILE HG12 . 16521 1 257 . 1 1 21 21 ILE HG13 H 1 0.72 0.02 . 2 . . . . 21 ILE HG13 . 16521 1 258 . 1 1 21 21 ILE HG21 H 1 0.6 0.02 . 1 . . . . 21 ILE HG2 . 16521 1 259 . 1 1 21 21 ILE HG22 H 1 0.6 0.02 . 1 . . . . 21 ILE HG2 . 16521 1 260 . 1 1 21 21 ILE HG23 H 1 0.6 0.02 . 1 . . . . 21 ILE HG2 . 16521 1 261 . 1 1 21 21 ILE C C 13 174.8 0.2 . 1 . . . . 21 ILE C . 16521 1 262 . 1 1 21 21 ILE CA C 13 60.5 0.2 . 1 . . . . 21 ILE CA . 16521 1 263 . 1 1 21 21 ILE CB C 13 38.9 0.2 . 1 . . . . 21 ILE CB . 16521 1 264 . 1 1 21 21 ILE CD1 C 13 13 0.2 . 1 . . . . 21 ILE CD1 . 16521 1 265 . 1 1 21 21 ILE CG1 C 13 25.9 0.2 . 1 . . . . 21 ILE CG1 . 16521 1 266 . 1 1 21 21 ILE CG2 C 13 17.4 0.2 . 1 . . . . 21 ILE CG2 . 16521 1 267 . 1 1 21 21 ILE N N 15 110.7 0.2 . 1 . . . . 21 ILE N . 16521 1 268 . 1 1 22 22 ARG H H 1 7.66 0.02 . 1 . . . . 22 ARG H . 16521 1 269 . 1 1 22 22 ARG HA H 1 3.66 0.02 . 1 . . . . 22 ARG HA . 16521 1 270 . 1 1 22 22 ARG HB2 H 1 2.12 0.02 . 2 . . . . 22 ARG HB2 . 16521 1 271 . 1 1 22 22 ARG HB3 H 1 1.87 0.02 . 2 . . . . 22 ARG HB3 . 16521 1 272 . 1 1 22 22 ARG HD2 H 1 3.22 0.02 . 2 . . . . 22 ARG HD2 . 16521 1 273 . 1 1 22 22 ARG HD3 H 1 3.22 0.02 . 2 . . . . 22 ARG HD3 . 16521 1 274 . 1 1 22 22 ARG HE H 1 7.03 0.02 . 1 . . . . 22 ARG HE . 16521 1 275 . 1 1 22 22 ARG HG2 H 1 1.54 0.02 . 2 . . . . 22 ARG HG2 . 16521 1 276 . 1 1 22 22 ARG HG3 H 1 1.47 0.02 . 2 . . . . 22 ARG HG3 . 16521 1 277 . 1 1 22 22 ARG C C 13 175.5 0.2 . 1 . . . . 22 ARG C . 16521 1 278 . 1 1 22 22 ARG CA C 13 57 0.2 . 1 . . . . 22 ARG CA . 16521 1 279 . 1 1 22 22 ARG CB C 13 26.3 0.2 . 1 . . . . 22 ARG CB . 16521 1 280 . 1 1 22 22 ARG CD C 13 43.7 0.2 . 1 . . . . 22 ARG CD . 16521 1 281 . 1 1 22 22 ARG CG C 13 27.2 0.2 . 1 . . . . 22 ARG CG . 16521 1 282 . 1 1 22 22 ARG N N 15 119.5 0.2 . 1 . . . . 22 ARG N . 16521 1 283 . 1 1 22 22 ARG NE N 15 85 0.2 . 1 . . . . 22 ARG NE . 16521 1 284 . 1 1 23 23 LYS H H 1 6.84 0.02 . 1 . . . . 23 LYS H . 16521 1 285 . 1 1 23 23 LYS HA H 1 4.94 0.02 . 1 . . . . 23 LYS HA . 16521 1 286 . 1 1 23 23 LYS HB2 H 1 1.89 0.02 . 2 . . . . 23 LYS HB2 . 16521 1 287 . 1 1 23 23 LYS HB3 H 1 1.22 0.02 . 2 . . . . 23 LYS HB3 . 16521 1 288 . 1 1 23 23 LYS HD2 H 1 1.82 0.02 . 2 . . . . 23 LYS HD2 . 16521 1 289 . 1 1 23 23 LYS HD3 H 1 1.82 0.02 . 2 . . . . 23 LYS HD3 . 16521 1 290 . 1 1 23 23 LYS HE2 H 1 2.87 0.02 . 2 . . . . 23 LYS HE2 . 16521 1 291 . 1 1 23 23 LYS HE3 H 1 2.87 0.02 . 2 . . . . 23 LYS HE3 . 16521 1 292 . 1 1 23 23 LYS HG2 H 1 1.31 0.02 . 2 . . . . 23 LYS HG2 . 16521 1 293 . 1 1 23 23 LYS HG3 H 1 1.12 0.02 . 2 . . . . 23 LYS HG3 . 16521 1 294 . 1 1 23 23 LYS C C 13 173.6 0.2 . 1 . . . . 23 LYS C . 16521 1 295 . 1 1 23 23 LYS CA C 13 52.9 0.2 . 1 . . . . 23 LYS CA . 16521 1 296 . 1 1 23 23 LYS CB C 13 38.8 0.2 . 1 . . . . 23 LYS CB . 16521 1 297 . 1 1 23 23 LYS CD C 13 28.7 0.2 . 1 . . . . 23 LYS CD . 16521 1 298 . 1 1 23 23 LYS CE C 13 42.4 0.2 . 1 . . . . 23 LYS CE . 16521 1 299 . 1 1 23 23 LYS CG C 13 23.9 0.2 . 1 . . . . 23 LYS CG . 16521 1 300 . 1 1 23 23 LYS N N 15 114.5 0.2 . 1 . . . . 23 LYS N . 16521 1 301 . 1 1 24 24 TYR H H 1 9.76 0.02 . 1 . . . . 24 TYR H . 16521 1 302 . 1 1 24 24 TYR HA H 1 5.28 0.02 . 1 . . . . 24 TYR HA . 16521 1 303 . 1 1 24 24 TYR HB2 H 1 2.83 0.02 . 2 . . . . 24 TYR HB2 . 16521 1 304 . 1 1 24 24 TYR HB3 H 1 2.69 0.02 . 2 . . . . 24 TYR HB3 . 16521 1 305 . 1 1 24 24 TYR HD1 H 1 7.02 0.02 . 3 . . . . 24 TYR HD1 . 16521 1 306 . 1 1 24 24 TYR HD2 H 1 7.02 0.02 . 3 . . . . 24 TYR HD2 . 16521 1 307 . 1 1 24 24 TYR HE1 H 1 6.72 0.02 . 3 . . . . 24 TYR HE1 . 16521 1 308 . 1 1 24 24 TYR HE2 H 1 6.72 0.02 . 3 . . . . 24 TYR HE2 . 16521 1 309 . 1 1 24 24 TYR C C 13 175.7 0.2 . 1 . . . . 24 TYR C . 16521 1 310 . 1 1 24 24 TYR CA C 13 58.1 0.2 . 1 . . . . 24 TYR CA . 16521 1 311 . 1 1 24 24 TYR CB C 13 42.2 0.2 . 1 . . . . 24 TYR CB . 16521 1 312 . 1 1 24 24 TYR CD1 C 13 133.3 0.2 . 3 . . . . 24 TYR CD1 . 16521 1 313 . 1 1 24 24 TYR CD2 C 13 133.3 0.2 . 3 . . . . 24 TYR CD2 . 16521 1 314 . 1 1 24 24 TYR CE1 C 13 118 0.2 . 3 . . . . 24 TYR CE1 . 16521 1 315 . 1 1 24 24 TYR CE2 C 13 118 0.2 . 3 . . . . 24 TYR CE2 . 16521 1 316 . 1 1 24 24 TYR N N 15 117.8 0.2 . 1 . . . . 24 TYR N . 16521 1 317 . 1 1 25 25 VAL H H 1 9.42 0.02 . 1 . . . . 25 VAL H . 16521 1 318 . 1 1 25 25 VAL HA H 1 5.5 0.02 . 1 . . . . 25 VAL HA . 16521 1 319 . 1 1 25 25 VAL HB H 1 2.29 0.02 . 1 . . . . 25 VAL HB . 16521 1 320 . 1 1 25 25 VAL HG11 H 1 1.22 0.02 . 1 . . . . 25 VAL HG1 . 16521 1 321 . 1 1 25 25 VAL HG12 H 1 1.22 0.02 . 1 . . . . 25 VAL HG1 . 16521 1 322 . 1 1 25 25 VAL HG13 H 1 1.22 0.02 . 1 . . . . 25 VAL HG1 . 16521 1 323 . 1 1 25 25 VAL HG21 H 1 1.06 0.02 . 1 . . . . 25 VAL HG2 . 16521 1 324 . 1 1 25 25 VAL HG22 H 1 1.06 0.02 . 1 . . . . 25 VAL HG2 . 16521 1 325 . 1 1 25 25 VAL HG23 H 1 1.06 0.02 . 1 . . . . 25 VAL HG2 . 16521 1 326 . 1 1 25 25 VAL CA C 13 58.5 0.2 . 1 . . . . 25 VAL CA . 16521 1 327 . 1 1 25 25 VAL CB C 13 35.4 0.2 . 1 . . . . 25 VAL CB . 16521 1 328 . 1 1 25 25 VAL CG1 C 13 21.2 0.2 . 1 . . . . 25 VAL CG1 . 16521 1 329 . 1 1 25 25 VAL CG2 C 13 21 0.2 . 1 . . . . 25 VAL CG2 . 16521 1 330 . 1 1 25 25 VAL N N 15 120.9 0.2 . 1 . . . . 25 VAL N . 16521 1 331 . 1 1 26 26 PRO HA H 1 4.43 0.02 . 1 . . . . 26 PRO HA . 16521 1 332 . 1 1 26 26 PRO HB2 H 1 2.47 0.02 . 2 . . . . 26 PRO HB2 . 16521 1 333 . 1 1 26 26 PRO HB3 H 1 1.96 0.02 . 2 . . . . 26 PRO HB3 . 16521 1 334 . 1 1 26 26 PRO HD2 H 1 4.58 0.02 . 2 . . . . 26 PRO HD2 . 16521 1 335 . 1 1 26 26 PRO HD3 H 1 4.58 0.02 . 2 . . . . 26 PRO HD3 . 16521 1 336 . 1 1 26 26 PRO HG2 H 1 2.43 0.02 . 2 . . . . 26 PRO HG2 . 16521 1 337 . 1 1 26 26 PRO HG3 H 1 2.12 0.02 . 2 . . . . 26 PRO HG3 . 16521 1 338 . 1 1 26 26 PRO C C 13 175.7 0.2 . 1 . . . . 26 PRO C . 16521 1 339 . 1 1 26 26 PRO CA C 13 63.6 0.2 . 1 . . . . 26 PRO CA . 16521 1 340 . 1 1 26 26 PRO CB C 13 32.5 0.2 . 1 . . . . 26 PRO CB . 16521 1 341 . 1 1 26 26 PRO CD C 13 52 0.2 . 1 . . . . 26 PRO CD . 16521 1 342 . 1 1 26 26 PRO CG C 13 29.5 0.2 . 1 . . . . 26 PRO CG . 16521 1 343 . 1 1 27 27 TYR H H 1 8.03 0.02 . 1 . . . . 27 TYR H . 16521 1 344 . 1 1 27 27 TYR HA H 1 5.04 0.02 . 1 . . . . 27 TYR HA . 16521 1 345 . 1 1 27 27 TYR HB2 H 1 2.71 0.02 . 2 . . . . 27 TYR HB2 . 16521 1 346 . 1 1 27 27 TYR HB3 H 1 2.67 0.02 . 2 . . . . 27 TYR HB3 . 16521 1 347 . 1 1 27 27 TYR HD1 H 1 6.93 0.02 . 3 . . . . 27 TYR HD1 . 16521 1 348 . 1 1 27 27 TYR HD2 H 1 6.93 0.02 . 3 . . . . 27 TYR HD2 . 16521 1 349 . 1 1 27 27 TYR HE1 H 1 6.65 0.02 . 3 . . . . 27 TYR HE1 . 16521 1 350 . 1 1 27 27 TYR HE2 H 1 6.65 0.02 . 3 . . . . 27 TYR HE2 . 16521 1 351 . 1 1 27 27 TYR C C 13 172.4 0.2 . 1 . . . . 27 TYR C . 16521 1 352 . 1 1 27 27 TYR CA C 13 58.4 0.2 . 1 . . . . 27 TYR CA . 16521 1 353 . 1 1 27 27 TYR CB C 13 40.6 0.2 . 1 . . . . 27 TYR CB . 16521 1 354 . 1 1 27 27 TYR CD1 C 13 133.2 0.2 . 3 . . . . 27 TYR CD1 . 16521 1 355 . 1 1 27 27 TYR CD2 C 13 133.2 0.2 . 3 . . . . 27 TYR CD2 . 16521 1 356 . 1 1 27 27 TYR CE1 C 13 117.8 0.2 . 3 . . . . 27 TYR CE1 . 16521 1 357 . 1 1 27 27 TYR CE2 C 13 117.8 0.2 . 3 . . . . 27 TYR CE2 . 16521 1 358 . 1 1 27 27 TYR N N 15 127.2 0.2 . 1 . . . . 27 TYR N . 16521 1 359 . 1 1 28 28 ALA H H 1 8.35 0.02 . 1 . . . . 28 ALA H . 16521 1 360 . 1 1 28 28 ALA HA H 1 4.98 0.02 . 1 . . . . 28 ALA HA . 16521 1 361 . 1 1 28 28 ALA HB1 H 1 1.05 0.02 . 1 . . . . 28 ALA HB . 16521 1 362 . 1 1 28 28 ALA HB2 H 1 1.05 0.02 . 1 . . . . 28 ALA HB . 16521 1 363 . 1 1 28 28 ALA HB3 H 1 1.05 0.02 . 1 . . . . 28 ALA HB . 16521 1 364 . 1 1 28 28 ALA C C 13 175.6 0.2 . 1 . . . . 28 ALA C . 16521 1 365 . 1 1 28 28 ALA CA C 13 49.7 0.2 . 1 . . . . 28 ALA CA . 16521 1 366 . 1 1 28 28 ALA CB C 13 22.2 0.2 . 1 . . . . 28 ALA CB . 16521 1 367 . 1 1 28 28 ALA N N 15 127.4 0.2 . 1 . . . . 28 ALA N . 16521 1 368 . 1 1 29 29 LEU H H 1 7.83 0.02 . 1 . . . . 29 LEU H . 16521 1 369 . 1 1 29 29 LEU HA H 1 4.81 0.02 . 1 . . . . 29 LEU HA . 16521 1 370 . 1 1 29 29 LEU HB2 H 1 1.74 0.02 . 1 . . . . 29 LEU HB2 . 16521 1 371 . 1 1 29 29 LEU HB3 H 1 1.1 0.02 . 1 . . . . 29 LEU HB3 . 16521 1 372 . 1 1 29 29 LEU HD11 H 1 0.86 0.02 . 1 . . . . 29 LEU HD1 . 16521 1 373 . 1 1 29 29 LEU HD12 H 1 0.86 0.02 . 1 . . . . 29 LEU HD1 . 16521 1 374 . 1 1 29 29 LEU HD13 H 1 0.86 0.02 . 1 . . . . 29 LEU HD1 . 16521 1 375 . 1 1 29 29 LEU HD21 H 1 0.66 0.02 . 1 . . . . 29 LEU HD2 . 16521 1 376 . 1 1 29 29 LEU HD22 H 1 0.66 0.02 . 1 . . . . 29 LEU HD2 . 16521 1 377 . 1 1 29 29 LEU HD23 H 1 0.66 0.02 . 1 . . . . 29 LEU HD2 . 16521 1 378 . 1 1 29 29 LEU HG H 1 1.61 0.02 . 1 . . . . 29 LEU HG . 16521 1 379 . 1 1 29 29 LEU C C 13 176.3 0.2 . 1 . . . . 29 LEU C . 16521 1 380 . 1 1 29 29 LEU CA C 13 53.3 0.2 . 1 . . . . 29 LEU CA . 16521 1 381 . 1 1 29 29 LEU CB C 13 45.2 0.2 . 1 . . . . 29 LEU CB . 16521 1 382 . 1 1 29 29 LEU CD1 C 13 25.8 0.2 . 2 . . . . 29 LEU CD1 . 16521 1 383 . 1 1 29 29 LEU CD2 C 13 22.9 0.2 . 2 . . . . 29 LEU CD2 . 16521 1 384 . 1 1 29 29 LEU CG C 13 26.3 0.2 . 1 . . . . 29 LEU CG . 16521 1 385 . 1 1 29 29 LEU N N 15 117.4 0.2 . 1 . . . . 29 LEU N . 16521 1 386 . 1 1 30 30 ILE H H 1 8.73 0.02 . 1 . . . . 30 ILE H . 16521 1 387 . 1 1 30 30 ILE HA H 1 4.9 0.02 . 1 . . . . 30 ILE HA . 16521 1 388 . 1 1 30 30 ILE HB H 1 1.62 0.02 . 1 . . . . 30 ILE HB . 16521 1 389 . 1 1 30 30 ILE HD11 H 1 0.7 0.02 . 1 . . . . 30 ILE HD1 . 16521 1 390 . 1 1 30 30 ILE HD12 H 1 0.7 0.02 . 1 . . . . 30 ILE HD1 . 16521 1 391 . 1 1 30 30 ILE HD13 H 1 0.7 0.02 . 1 . . . . 30 ILE HD1 . 16521 1 392 . 1 1 30 30 ILE HG12 H 1 1.61 0.02 . 2 . . . . 30 ILE HG12 . 16521 1 393 . 1 1 30 30 ILE HG13 H 1 0.61 0.02 . 2 . . . . 30 ILE HG13 . 16521 1 394 . 1 1 30 30 ILE HG21 H 1 0.78 0.02 . 1 . . . . 30 ILE HG2 . 16521 1 395 . 1 1 30 30 ILE HG22 H 1 0.78 0.02 . 1 . . . . 30 ILE HG2 . 16521 1 396 . 1 1 30 30 ILE HG23 H 1 0.78 0.02 . 1 . . . . 30 ILE HG2 . 16521 1 397 . 1 1 30 30 ILE C C 13 174.6 0.2 . 1 . . . . 30 ILE C . 16521 1 398 . 1 1 30 30 ILE CA C 13 61 0.2 . 1 . . . . 30 ILE CA . 16521 1 399 . 1 1 30 30 ILE CB C 13 40.5 0.2 . 1 . . . . 30 ILE CB . 16521 1 400 . 1 1 30 30 ILE CD1 C 13 15 0.2 . 1 . . . . 30 ILE CD1 . 16521 1 401 . 1 1 30 30 ILE CG1 C 13 28 0.2 . 1 . . . . 30 ILE CG1 . 16521 1 402 . 1 1 30 30 ILE CG2 C 13 19.1 0.2 . 1 . . . . 30 ILE CG2 . 16521 1 403 . 1 1 30 30 ILE N N 15 122.4 0.2 . 1 . . . . 30 ILE N . 16521 1 404 . 1 1 31 31 ARG H H 1 8.76 0.02 . 1 . . . . 31 ARG H . 16521 1 405 . 1 1 31 31 ARG HA H 1 4.88 0.02 . 1 . . . . 31 ARG HA . 16521 1 406 . 1 1 31 31 ARG HB2 H 1 1.87 0.02 . 2 . . . . 31 ARG HB2 . 16521 1 407 . 1 1 31 31 ARG HB3 H 1 1.58 0.02 . 2 . . . . 31 ARG HB3 . 16521 1 408 . 1 1 31 31 ARG HD2 H 1 3.25 0.02 . 2 . . . . 31 ARG HD2 . 16521 1 409 . 1 1 31 31 ARG HD3 H 1 3.16 0.02 . 2 . . . . 31 ARG HD3 . 16521 1 410 . 1 1 31 31 ARG HE H 1 7.33 0.02 . 1 . . . . 31 ARG HE . 16521 1 411 . 1 1 31 31 ARG HG2 H 1 1.58 0.02 . 2 . . . . 31 ARG HG2 . 16521 1 412 . 1 1 31 31 ARG HG3 H 1 1.58 0.02 . 2 . . . . 31 ARG HG3 . 16521 1 413 . 1 1 31 31 ARG C C 13 174.8 0.2 . 1 . . . . 31 ARG C . 16521 1 414 . 1 1 31 31 ARG CA C 13 54.9 0.2 . 1 . . . . 31 ARG CA . 16521 1 415 . 1 1 31 31 ARG CB C 13 34.7 0.2 . 1 . . . . 31 ARG CB . 16521 1 416 . 1 1 31 31 ARG CD C 13 43.7 0.2 . 1 . . . . 31 ARG CD . 16521 1 417 . 1 1 31 31 ARG CG C 13 28.8 0.2 . 1 . . . . 31 ARG CG . 16521 1 418 . 1 1 31 31 ARG N N 15 123.4 0.2 . 1 . . . . 31 ARG N . 16521 1 419 . 1 1 31 31 ARG NE N 15 83.4 0.2 . 1 . . . . 31 ARG NE . 16521 1 420 . 1 1 32 32 LYS H H 1 9.48 0.02 . 1 . . . . 32 LYS H . 16521 1 421 . 1 1 32 32 LYS HA H 1 4.38 0.02 . 1 . . . . 32 LYS HA . 16521 1 422 . 1 1 32 32 LYS HB2 H 1 1.91 0.02 . 2 . . . . 32 LYS HB2 . 16521 1 423 . 1 1 32 32 LYS HB3 H 1 1.48 0.02 . 2 . . . . 32 LYS HB3 . 16521 1 424 . 1 1 32 32 LYS HD2 H 1 1.41 0.02 . 2 . . . . 32 LYS HD2 . 16521 1 425 . 1 1 32 32 LYS HD3 H 1 1.32 0.02 . 2 . . . . 32 LYS HD3 . 16521 1 426 . 1 1 32 32 LYS HE2 H 1 2.79 0.02 . 2 . . . . 32 LYS HE2 . 16521 1 427 . 1 1 32 32 LYS HE3 H 1 2.79 0.02 . 2 . . . . 32 LYS HE3 . 16521 1 428 . 1 1 32 32 LYS HG2 H 1 1.2 0.02 . 2 . . . . 32 LYS HG2 . 16521 1 429 . 1 1 32 32 LYS HG3 H 1 0.71 0.02 . 2 . . . . 32 LYS HG3 . 16521 1 430 . 1 1 32 32 LYS C C 13 176.6 0.2 . 1 . . . . 32 LYS C . 16521 1 431 . 1 1 32 32 LYS CA C 13 56.6 0.2 . 1 . . . . 32 LYS CA . 16521 1 432 . 1 1 32 32 LYS CB C 13 34.7 0.2 . 1 . . . . 32 LYS CB . 16521 1 433 . 1 1 32 32 LYS CD C 13 29.3 0.2 . 1 . . . . 32 LYS CD . 16521 1 434 . 1 1 32 32 LYS CE C 13 42.5 0.2 . 1 . . . . 32 LYS CE . 16521 1 435 . 1 1 32 32 LYS CG C 13 25.8 0.2 . 1 . . . . 32 LYS CG . 16521 1 436 . 1 1 32 32 LYS N N 15 125 0.2 . 1 . . . . 32 LYS N . 16521 1 437 . 1 1 33 33 VAL H H 1 7.9 0.02 . 1 . . . . 33 VAL H . 16521 1 438 . 1 1 33 33 VAL HA H 1 3.59 0.02 . 1 . . . . 33 VAL HA . 16521 1 439 . 1 1 33 33 VAL HB H 1 1.7 0.02 . 1 . . . . 33 VAL HB . 16521 1 440 . 1 1 33 33 VAL HG11 H 1 0.79 0.02 . 1 . . . . 33 VAL HG1 . 16521 1 441 . 1 1 33 33 VAL HG12 H 1 0.79 0.02 . 1 . . . . 33 VAL HG1 . 16521 1 442 . 1 1 33 33 VAL HG13 H 1 0.79 0.02 . 1 . . . . 33 VAL HG1 . 16521 1 443 . 1 1 33 33 VAL HG21 H 1 0.65 0.02 . 1 . . . . 33 VAL HG2 . 16521 1 444 . 1 1 33 33 VAL HG22 H 1 0.65 0.02 . 1 . . . . 33 VAL HG2 . 16521 1 445 . 1 1 33 33 VAL HG23 H 1 0.65 0.02 . 1 . . . . 33 VAL HG2 . 16521 1 446 . 1 1 33 33 VAL C C 13 177.5 0.2 . 1 . . . . 33 VAL C . 16521 1 447 . 1 1 33 33 VAL CA C 13 65 0.2 . 1 . . . . 33 VAL CA . 16521 1 448 . 1 1 33 33 VAL CB C 13 31.2 0.2 . 1 . . . . 33 VAL CB . 16521 1 449 . 1 1 33 33 VAL CG1 C 13 20.7 0.2 . 1 . . . . 33 VAL CG1 . 16521 1 450 . 1 1 33 33 VAL CG2 C 13 22.2 0.2 . 1 . . . . 33 VAL CG2 . 16521 1 451 . 1 1 33 33 VAL N N 15 128 0.2 . 1 . . . . 33 VAL N . 16521 1 452 . 1 1 34 34 GLY H H 1 8.97 0.02 . 1 . . . . 34 GLY H . 16521 1 453 . 1 1 34 34 GLY HA2 H 1 4.17 0.02 . 2 . . . . 34 GLY HA2 . 16521 1 454 . 1 1 34 34 GLY HA3 H 1 3.72 0.02 . 2 . . . . 34 GLY HA3 . 16521 1 455 . 1 1 34 34 GLY C C 13 174 0.2 . 1 . . . . 34 GLY C . 16521 1 456 . 1 1 34 34 GLY CA C 13 45 0.2 . 1 . . . . 34 GLY CA . 16521 1 457 . 1 1 34 34 GLY N N 15 114.9 0.2 . 1 . . . . 34 GLY N . 16521 1 458 . 1 1 35 35 VAL H H 1 7.34 0.02 . 1 . . . . 35 VAL H . 16521 1 459 . 1 1 35 35 VAL HA H 1 4.65 0.02 . 1 . . . . 35 VAL HA . 16521 1 460 . 1 1 35 35 VAL HB H 1 2.24 0.02 . 1 . . . . 35 VAL HB . 16521 1 461 . 1 1 35 35 VAL HG11 H 1 1.05 0.02 . 1 . . . . 35 VAL HG1 . 16521 1 462 . 1 1 35 35 VAL HG12 H 1 1.05 0.02 . 1 . . . . 35 VAL HG1 . 16521 1 463 . 1 1 35 35 VAL HG13 H 1 1.05 0.02 . 1 . . . . 35 VAL HG1 . 16521 1 464 . 1 1 35 35 VAL HG21 H 1 0.85 0.02 . 1 . . . . 35 VAL HG2 . 16521 1 465 . 1 1 35 35 VAL HG22 H 1 0.85 0.02 . 1 . . . . 35 VAL HG2 . 16521 1 466 . 1 1 35 35 VAL HG23 H 1 0.85 0.02 . 1 . . . . 35 VAL HG2 . 16521 1 467 . 1 1 35 35 VAL CA C 13 59.3 0.2 . 1 . . . . 35 VAL CA . 16521 1 468 . 1 1 35 35 VAL CB C 13 32.1 0.2 . 1 . . . . 35 VAL CB . 16521 1 469 . 1 1 35 35 VAL CG1 C 13 22.3 0.2 . 1 . . . . 35 VAL CG1 . 16521 1 470 . 1 1 35 35 VAL CG2 C 13 20.1 0.2 . 1 . . . . 35 VAL CG2 . 16521 1 471 . 1 1 35 35 VAL N N 15 118.7 0.2 . 1 . . . . 35 VAL N . 16521 1 472 . 1 1 36 36 PRO HA H 1 4.59 0.02 . 1 . . . . 36 PRO HA . 16521 1 473 . 1 1 36 36 PRO HB2 H 1 2.25 0.02 . 2 . . . . 36 PRO HB2 . 16521 1 474 . 1 1 36 36 PRO HB3 H 1 2.01 0.02 . 2 . . . . 36 PRO HB3 . 16521 1 475 . 1 1 36 36 PRO HD2 H 1 3.82 0.02 . 2 . . . . 36 PRO HD2 . 16521 1 476 . 1 1 36 36 PRO HD3 H 1 3.55 0.02 . 2 . . . . 36 PRO HD3 . 16521 1 477 . 1 1 36 36 PRO HG2 H 1 2.01 0.02 . 2 . . . . 36 PRO HG2 . 16521 1 478 . 1 1 36 36 PRO HG3 H 1 1.95 0.02 . 2 . . . . 36 PRO HG3 . 16521 1 479 . 1 1 36 36 PRO C C 13 177.3 0.2 . 1 . . . . 36 PRO C . 16521 1 480 . 1 1 36 36 PRO CA C 13 64.1 0.2 . 1 . . . . 36 PRO CA . 16521 1 481 . 1 1 36 36 PRO CB C 13 32.5 0.2 . 1 . . . . 36 PRO CB . 16521 1 482 . 1 1 36 36 PRO CD C 13 50.8 0.2 . 1 . . . . 36 PRO CD . 16521 1 483 . 1 1 36 36 PRO CG C 13 26.8 0.2 . 1 . . . . 36 PRO CG . 16521 1 484 . 1 1 37 37 ASP H H 1 8.45 0.02 . 1 . . . . 37 ASP H . 16521 1 485 . 1 1 37 37 ASP HA H 1 4.55 0.02 . 1 . . . . 37 ASP HA . 16521 1 486 . 1 1 37 37 ASP HB2 H 1 2.75 0.02 . 2 . . . . 37 ASP HB2 . 16521 1 487 . 1 1 37 37 ASP HB3 H 1 2.75 0.02 . 2 . . . . 37 ASP HB3 . 16521 1 488 . 1 1 37 37 ASP C C 13 175.8 0.2 . 1 . . . . 37 ASP C . 16521 1 489 . 1 1 37 37 ASP CA C 13 54.7 0.2 . 1 . . . . 37 ASP CA . 16521 1 490 . 1 1 37 37 ASP CB C 13 40.2 0.2 . 1 . . . . 37 ASP CB . 16521 1 491 . 1 1 37 37 ASP N N 15 116.4 0.2 . 1 . . . . 37 ASP N . 16521 1 492 . 1 1 38 38 ARG H H 1 7.53 0.02 . 1 . . . . 38 ARG H . 16521 1 493 . 1 1 38 38 ARG HA H 1 4.62 0.02 . 1 . . . . 38 ARG HA . 16521 1 494 . 1 1 38 38 ARG HB2 H 1 1.93 0.02 . 2 . . . . 38 ARG HB2 . 16521 1 495 . 1 1 38 38 ARG HB3 H 1 1.85 0.02 . 2 . . . . 38 ARG HB3 . 16521 1 496 . 1 1 38 38 ARG HD2 H 1 3.25 0.02 . 2 . . . . 38 ARG HD2 . 16521 1 497 . 1 1 38 38 ARG HD3 H 1 3.25 0.02 . 2 . . . . 38 ARG HD3 . 16521 1 498 . 1 1 38 38 ARG HE H 1 7.16 0.02 . 1 . . . . 38 ARG HE . 16521 1 499 . 1 1 38 38 ARG HG2 H 1 1.72 0.02 . 2 . . . . 38 ARG HG2 . 16521 1 500 . 1 1 38 38 ARG HG3 H 1 1.63 0.02 . 2 . . . . 38 ARG HG3 . 16521 1 501 . 1 1 38 38 ARG C C 13 176.2 0.2 . 1 . . . . 38 ARG C . 16521 1 502 . 1 1 38 38 ARG CA C 13 53.9 0.2 . 1 . . . . 38 ARG CA . 16521 1 503 . 1 1 38 38 ARG CB C 13 31.2 0.2 . 1 . . . . 38 ARG CB . 16521 1 504 . 1 1 38 38 ARG CD C 13 42.6 0.2 . 1 . . . . 38 ARG CD . 16521 1 505 . 1 1 38 38 ARG CG C 13 27.1 0.2 . 1 . . . . 38 ARG CG . 16521 1 506 . 1 1 38 38 ARG N N 15 118.5 0.2 . 1 . . . . 38 ARG N . 16521 1 507 . 1 1 38 38 ARG NE N 15 85 0.2 . 1 . . . . 38 ARG NE . 16521 1 508 . 1 1 39 39 THR H H 1 8.49 0.02 . 1 . . . . 39 THR H . 16521 1 509 . 1 1 39 39 THR HA H 1 4.34 0.02 . 1 . . . . 39 THR HA . 16521 1 510 . 1 1 39 39 THR HB H 1 4.05 0.02 . 1 . . . . 39 THR HB . 16521 1 511 . 1 1 39 39 THR HG1 H 1 6.81 0.02 . 1 . . . . 39 THR HG1 . 16521 1 512 . 1 1 39 39 THR HG21 H 1 1.38 0.02 . 1 . . . . 39 THR HG2 . 16521 1 513 . 1 1 39 39 THR HG22 H 1 1.38 0.02 . 1 . . . . 39 THR HG2 . 16521 1 514 . 1 1 39 39 THR HG23 H 1 1.38 0.02 . 1 . . . . 39 THR HG2 . 16521 1 515 . 1 1 39 39 THR CA C 13 61.3 0.2 . 1 . . . . 39 THR CA . 16521 1 516 . 1 1 39 39 THR CB C 13 69.7 0.2 . 1 . . . . 39 THR CB . 16521 1 517 . 1 1 39 39 THR CG2 C 13 21.7 0.2 . 1 . . . . 39 THR CG2 . 16521 1 518 . 1 1 39 39 THR N N 15 121.8 0.2 . 1 . . . . 39 THR N . 16521 1 519 . 1 1 40 40 PRO HA H 1 4.72 0.02 . 1 . . . . 40 PRO HA . 16521 1 520 . 1 1 40 40 PRO HB2 H 1 1.99 0.02 . 2 . . . . 40 PRO HB2 . 16521 1 521 . 1 1 40 40 PRO HB3 H 1 1.68 0.02 . 2 . . . . 40 PRO HB3 . 16521 1 522 . 1 1 40 40 PRO HD2 H 1 4 0.02 . 2 . . . . 40 PRO HD2 . 16521 1 523 . 1 1 40 40 PRO HD3 H 1 3.78 0.02 . 2 . . . . 40 PRO HD3 . 16521 1 524 . 1 1 40 40 PRO HG2 H 1 2.03 0.02 . 2 . . . . 40 PRO HG2 . 16521 1 525 . 1 1 40 40 PRO HG3 H 1 1.99 0.02 . 2 . . . . 40 PRO HG3 . 16521 1 526 . 1 1 40 40 PRO CA C 13 62.2 0.2 . 1 . . . . 40 PRO CA . 16521 1 527 . 1 1 40 40 PRO CB C 13 33.7 0.2 . 1 . . . . 40 PRO CB . 16521 1 528 . 1 1 40 40 PRO CD C 13 50.9 0.2 . 1 . . . . 40 PRO CD . 16521 1 529 . 1 1 40 40 PRO CG C 13 27.3 0.2 . 1 . . . . 40 PRO CG . 16521 1 530 . 1 1 41 41 ILE H H 1 8.76 0.02 . 1 . . . . 41 ILE H . 16521 1 531 . 1 1 41 41 ILE HA H 1 4.63 0.02 . 1 . . . . 41 ILE HA . 16521 1 532 . 1 1 41 41 ILE HB H 1 1.65 0.02 . 1 . . . . 41 ILE HB . 16521 1 533 . 1 1 41 41 ILE HD11 H 1 0.91 0.02 . 1 . . . . 41 ILE HD1 . 16521 1 534 . 1 1 41 41 ILE HD12 H 1 0.91 0.02 . 1 . . . . 41 ILE HD1 . 16521 1 535 . 1 1 41 41 ILE HD13 H 1 0.91 0.02 . 1 . . . . 41 ILE HD1 . 16521 1 536 . 1 1 41 41 ILE HG12 H 1 1.59 0.02 . 2 . . . . 41 ILE HG12 . 16521 1 537 . 1 1 41 41 ILE HG13 H 1 1.36 0.02 . 2 . . . . 41 ILE HG13 . 16521 1 538 . 1 1 41 41 ILE HG21 H 1 0.84 0.02 . 1 . . . . 41 ILE HG2 . 16521 1 539 . 1 1 41 41 ILE HG22 H 1 0.84 0.02 . 1 . . . . 41 ILE HG2 . 16521 1 540 . 1 1 41 41 ILE HG23 H 1 0.84 0.02 . 1 . . . . 41 ILE HG2 . 16521 1 541 . 1 1 41 41 ILE CA C 13 57.3 0.2 . 1 . . . . 41 ILE CA . 16521 1 542 . 1 1 41 41 ILE CB C 13 40.2 0.2 . 1 . . . . 41 ILE CB . 16521 1 543 . 1 1 41 41 ILE CD1 C 13 12.9 0.2 . 1 . . . . 41 ILE CD1 . 16521 1 544 . 1 1 41 41 ILE CG1 C 13 28.1 0.2 . 1 . . . . 41 ILE CG1 . 16521 1 545 . 1 1 41 41 ILE CG2 C 13 16.1 0.2 . 1 . . . . 41 ILE CG2 . 16521 1 546 . 1 1 41 41 ILE N N 15 122.9 0.2 . 1 . . . . 41 ILE N . 16521 1 547 . 1 1 42 42 PRO HA H 1 5.32 0.02 . 1 . . . . 42 PRO HA . 16521 1 548 . 1 1 42 42 PRO HB2 H 1 1.94 0.02 . 2 . . . . 42 PRO HB2 . 16521 1 549 . 1 1 42 42 PRO HB3 H 1 1.64 0.02 . 2 . . . . 42 PRO HB3 . 16521 1 550 . 1 1 42 42 PRO HD2 H 1 3.92 0.02 . 2 . . . . 42 PRO HD2 . 16521 1 551 . 1 1 42 42 PRO HD3 H 1 3.8 0.02 . 2 . . . . 42 PRO HD3 . 16521 1 552 . 1 1 42 42 PRO HG2 H 1 2.08 0.02 . 2 . . . . 42 PRO HG2 . 16521 1 553 . 1 1 42 42 PRO HG3 H 1 2 0.02 . 2 . . . . 42 PRO HG3 . 16521 1 554 . 1 1 42 42 PRO C C 13 177.2 0.2 . 1 . . . . 42 PRO C . 16521 1 555 . 1 1 42 42 PRO CA C 13 61.1 0.2 . 1 . . . . 42 PRO CA . 16521 1 556 . 1 1 42 42 PRO CB C 13 33.1 0.2 . 1 . . . . 42 PRO CB . 16521 1 557 . 1 1 42 42 PRO CD C 13 51.2 0.2 . 1 . . . . 42 PRO CD . 16521 1 558 . 1 1 42 42 PRO CG C 13 26.7 0.2 . 1 . . . . 42 PRO CG . 16521 1 559 . 1 1 43 43 THR H H 1 8.58 0.02 . 1 . . . . 43 THR H . 16521 1 560 . 1 1 43 43 THR HA H 1 4.54 0.02 . 1 . . . . 43 THR HA . 16521 1 561 . 1 1 43 43 THR HB H 1 3.84 0.02 . 1 . . . . 43 THR HB . 16521 1 562 . 1 1 43 43 THR HG21 H 1 0.97 0.02 . 1 . . . . 43 THR HG2 . 16521 1 563 . 1 1 43 43 THR HG22 H 1 0.97 0.02 . 1 . . . . 43 THR HG2 . 16521 1 564 . 1 1 43 43 THR HG23 H 1 0.97 0.02 . 1 . . . . 43 THR HG2 . 16521 1 565 . 1 1 43 43 THR C C 13 171.9 0.2 . 1 . . . . 43 THR C . 16521 1 566 . 1 1 43 43 THR CA C 13 61 0.2 . 1 . . . . 43 THR CA . 16521 1 567 . 1 1 43 43 THR CB C 13 70.5 0.2 . 1 . . . . 43 THR CB . 16521 1 568 . 1 1 43 43 THR CG2 C 13 20.6 0.2 . 1 . . . . 43 THR CG2 . 16521 1 569 . 1 1 43 43 THR N N 15 114.2 0.2 . 1 . . . . 43 THR N . 16521 1 570 . 1 1 44 44 THR H H 1 8.11 0.02 . 1 . . . . 44 THR H . 16521 1 571 . 1 1 44 44 THR HA H 1 4.94 0.02 . 1 . . . . 44 THR HA . 16521 1 572 . 1 1 44 44 THR HB H 1 4.15 0.02 . 1 . . . . 44 THR HB . 16521 1 573 . 1 1 44 44 THR HG1 H 1 6.65 0.02 . 1 . . . . 44 THR HG1 . 16521 1 574 . 1 1 44 44 THR HG21 H 1 1.16 0.02 . 1 . . . . 44 THR HG2 . 16521 1 575 . 1 1 44 44 THR HG22 H 1 1.16 0.02 . 1 . . . . 44 THR HG2 . 16521 1 576 . 1 1 44 44 THR HG23 H 1 1.16 0.02 . 1 . . . . 44 THR HG2 . 16521 1 577 . 1 1 44 44 THR C C 13 171.8 0.2 . 1 . . . . 44 THR C . 16521 1 578 . 1 1 44 44 THR CA C 13 59.5 0.2 . 1 . . . . 44 THR CA . 16521 1 579 . 1 1 44 44 THR CB C 13 70.9 0.2 . 1 . . . . 44 THR CB . 16521 1 580 . 1 1 44 44 THR CG2 C 13 19.1 0.2 . 1 . . . . 44 THR CG2 . 16521 1 581 . 1 1 44 44 THR N N 15 118.4 0.2 . 1 . . . . 44 THR N . 16521 1 582 . 1 1 45 45 TYR H H 1 7.83 0.02 . 1 . . . . 45 TYR H . 16521 1 583 . 1 1 45 45 TYR HA H 1 5.07 0.02 . 1 . . . . 45 TYR HA . 16521 1 584 . 1 1 45 45 TYR HB2 H 1 3.21 0.02 . 2 . . . . 45 TYR HB2 . 16521 1 585 . 1 1 45 45 TYR HB3 H 1 2.78 0.02 . 2 . . . . 45 TYR HB3 . 16521 1 586 . 1 1 45 45 TYR HD1 H 1 7.2 0.02 . 3 . . . . 45 TYR HD1 . 16521 1 587 . 1 1 45 45 TYR HD2 H 1 7.2 0.02 . 3 . . . . 45 TYR HD2 . 16521 1 588 . 1 1 45 45 TYR HE1 H 1 6.86 0.02 . 3 . . . . 45 TYR HE1 . 16521 1 589 . 1 1 45 45 TYR HE2 H 1 6.86 0.02 . 3 . . . . 45 TYR HE2 . 16521 1 590 . 1 1 45 45 TYR CA C 13 55.2 0.2 . 1 . . . . 45 TYR CA . 16521 1 591 . 1 1 45 45 TYR CB C 13 43.6 0.2 . 1 . . . . 45 TYR CB . 16521 1 592 . 1 1 45 45 TYR CD1 C 13 133.3 0.2 . 3 . . . . 45 TYR CD1 . 16521 1 593 . 1 1 45 45 TYR CD2 C 13 133.3 0.2 . 3 . . . . 45 TYR CD2 . 16521 1 594 . 1 1 45 45 TYR CE1 C 13 118.6 0.2 . 3 . . . . 45 TYR CE1 . 16521 1 595 . 1 1 45 45 TYR CE2 C 13 118.6 0.2 . 3 . . . . 45 TYR CE2 . 16521 1 596 . 1 1 45 45 TYR N N 15 124.5 0.2 . 1 . . . . 45 TYR N . 16521 1 597 . 1 1 46 46 PRO HA H 1 4.46 0.02 . 1 . . . . 46 PRO HA . 16521 1 598 . 1 1 46 46 PRO HB2 H 1 2.09 0.02 . 2 . . . . 46 PRO HB2 . 16521 1 599 . 1 1 46 46 PRO HB3 H 1 1.72 0.02 . 2 . . . . 46 PRO HB3 . 16521 1 600 . 1 1 46 46 PRO HD2 H 1 3.37 0.02 . 2 . . . . 46 PRO HD2 . 16521 1 601 . 1 1 46 46 PRO HD3 H 1 2.48 0.02 . 2 . . . . 46 PRO HD3 . 16521 1 602 . 1 1 46 46 PRO HG2 H 1 1.81 0.02 . 2 . . . . 46 PRO HG2 . 16521 1 603 . 1 1 46 46 PRO HG3 H 1 1.52 0.02 . 2 . . . . 46 PRO HG3 . 16521 1 604 . 1 1 46 46 PRO C C 13 174.1 0.2 . 1 . . . . 46 PRO C . 16521 1 605 . 1 1 46 46 PRO CA C 13 62.6 0.2 . 1 . . . . 46 PRO CA . 16521 1 606 . 1 1 46 46 PRO CB C 13 28.8 0.2 . 1 . . . . 46 PRO CB . 16521 1 607 . 1 1 46 46 PRO CD C 13 50.4 0.2 . 1 . . . . 46 PRO CD . 16521 1 608 . 1 1 46 46 PRO CG C 13 27.1 0.2 . 1 . . . . 46 PRO CG . 16521 1 609 . 1 1 47 47 GLU H H 1 7.8 0.02 . 1 . . . . 47 GLU H . 16521 1 610 . 1 1 47 47 GLU HA H 1 4.06 0.02 . 1 . . . . 47 GLU HA . 16521 1 611 . 1 1 47 47 GLU HB2 H 1 1.9 0.02 . 2 . . . . 47 GLU HB2 . 16521 1 612 . 1 1 47 47 GLU HB3 H 1 1.81 0.02 . 2 . . . . 47 GLU HB3 . 16521 1 613 . 1 1 47 47 GLU HG2 H 1 2.06 0.02 . 2 . . . . 47 GLU HG2 . 16521 1 614 . 1 1 47 47 GLU HG3 H 1 2.06 0.02 . 2 . . . . 47 GLU HG3 . 16521 1 615 . 1 1 47 47 GLU C C 13 172.8 0.2 . 1 . . . . 47 GLU C . 16521 1 616 . 1 1 47 47 GLU CA C 13 55.4 0.2 . 1 . . . . 47 GLU CA . 16521 1 617 . 1 1 47 47 GLU CB C 13 33.4 0.2 . 1 . . . . 47 GLU CB . 16521 1 618 . 1 1 47 47 GLU CG C 13 36.7 0.2 . 1 . . . . 47 GLU CG . 16521 1 619 . 1 1 47 47 GLU N N 15 124.3 0.2 . 1 . . . . 47 GLU N . 16521 1 620 . 1 1 48 48 PHE H H 1 7.88 0.02 . 1 . . . . 48 PHE H . 16521 1 621 . 1 1 48 48 PHE HA H 1 5.25 0.02 . 1 . . . . 48 PHE HA . 16521 1 622 . 1 1 48 48 PHE HB2 H 1 2.78 0.02 . 2 . . . . 48 PHE HB2 . 16521 1 623 . 1 1 48 48 PHE HB3 H 1 2.74 0.02 . 2 . . . . 48 PHE HB3 . 16521 1 624 . 1 1 48 48 PHE HD1 H 1 6.85 0.02 . 3 . . . . 48 PHE HD1 . 16521 1 625 . 1 1 48 48 PHE HD2 H 1 6.85 0.02 . 3 . . . . 48 PHE HD2 . 16521 1 626 . 1 1 48 48 PHE HE1 H 1 7.18 0.02 . 3 . . . . 48 PHE HE1 . 16521 1 627 . 1 1 48 48 PHE HE2 H 1 7.18 0.02 . 3 . . . . 48 PHE HE2 . 16521 1 628 . 1 1 48 48 PHE HZ H 1 7.17 0.02 . 1 . . . . 48 PHE HZ . 16521 1 629 . 1 1 48 48 PHE C C 13 176.2 0.2 . 1 . . . . 48 PHE C . 16521 1 630 . 1 1 48 48 PHE CA C 13 55.8 0.2 . 1 . . . . 48 PHE CA . 16521 1 631 . 1 1 48 48 PHE CB C 13 41.5 0.2 . 1 . . . . 48 PHE CB . 16521 1 632 . 1 1 48 48 PHE CD1 C 13 132.2 0.2 . 3 . . . . 48 PHE CD1 . 16521 1 633 . 1 1 48 48 PHE CD2 C 13 132.2 0.2 . 3 . . . . 48 PHE CD2 . 16521 1 634 . 1 1 48 48 PHE CE1 C 13 131.2 0.2 . 3 . . . . 48 PHE CE1 . 16521 1 635 . 1 1 48 48 PHE CE2 C 13 131.2 0.2 . 3 . . . . 48 PHE CE2 . 16521 1 636 . 1 1 48 48 PHE CZ C 13 129.5 0.2 . 1 . . . . 48 PHE CZ . 16521 1 637 . 1 1 48 48 PHE N N 15 117.7 0.2 . 1 . . . . 48 PHE N . 16521 1 638 . 1 1 49 49 TYR H H 1 9.57 0.02 . 1 . . . . 49 TYR H . 16521 1 639 . 1 1 49 49 TYR HA H 1 4.85 0.02 . 1 . . . . 49 TYR HA . 16521 1 640 . 1 1 49 49 TYR HB2 H 1 3.64 0.02 . 2 . . . . 49 TYR HB2 . 16521 1 641 . 1 1 49 49 TYR HB3 H 1 2.68 0.02 . 2 . . . . 49 TYR HB3 . 16521 1 642 . 1 1 49 49 TYR HD1 H 1 7.27 0.02 . 3 . . . . 49 TYR HD1 . 16521 1 643 . 1 1 49 49 TYR HD2 H 1 7.27 0.02 . 3 . . . . 49 TYR HD2 . 16521 1 644 . 1 1 49 49 TYR HE1 H 1 6.71 0.02 . 3 . . . . 49 TYR HE1 . 16521 1 645 . 1 1 49 49 TYR HE2 H 1 6.71 0.02 . 3 . . . . 49 TYR HE2 . 16521 1 646 . 1 1 49 49 TYR C C 13 175.7 0.2 . 1 . . . . 49 TYR C . 16521 1 647 . 1 1 49 49 TYR CA C 13 58.1 0.2 . 1 . . . . 49 TYR CA . 16521 1 648 . 1 1 49 49 TYR CB C 13 42.2 0.2 . 1 . . . . 49 TYR CB . 16521 1 649 . 1 1 49 49 TYR CD1 C 13 132.8 0.2 . 3 . . . . 49 TYR CD1 . 16521 1 650 . 1 1 49 49 TYR CD2 C 13 132.8 0.2 . 3 . . . . 49 TYR CD2 . 16521 1 651 . 1 1 49 49 TYR CE1 C 13 118.6 0.2 . 3 . . . . 49 TYR CE1 . 16521 1 652 . 1 1 49 49 TYR CE2 C 13 118.6 0.2 . 3 . . . . 49 TYR CE2 . 16521 1 653 . 1 1 49 49 TYR N N 15 120.4 0.2 . 1 . . . . 49 TYR N . 16521 1 654 . 1 1 50 50 ASP H H 1 8.9 0.02 . 1 . . . . 50 ASP H . 16521 1 655 . 1 1 50 50 ASP HA H 1 4.94 0.02 . 1 . . . . 50 ASP HA . 16521 1 656 . 1 1 50 50 ASP HB2 H 1 2.93 0.02 . 2 . . . . 50 ASP HB2 . 16521 1 657 . 1 1 50 50 ASP HB3 H 1 2.74 0.02 . 2 . . . . 50 ASP HB3 . 16521 1 658 . 1 1 50 50 ASP C C 13 176.5 0.2 . 1 . . . . 50 ASP C . 16521 1 659 . 1 1 50 50 ASP CA C 13 57.3 0.2 . 1 . . . . 50 ASP CA . 16521 1 660 . 1 1 50 50 ASP CB C 13 41.8 0.2 . 1 . . . . 50 ASP CB . 16521 1 661 . 1 1 50 50 ASP N N 15 122.4 0.2 . 1 . . . . 50 ASP N . 16521 1 662 . 1 1 51 51 LEU H H 1 8.44 0.02 . 1 . . . . 51 LEU H . 16521 1 663 . 1 1 51 51 LEU HA H 1 4.69 0.02 . 1 . . . . 51 LEU HA . 16521 1 664 . 1 1 51 51 LEU HB2 H 1 1.8 0.02 . 2 . . . . 51 LEU HB2 . 16521 1 665 . 1 1 51 51 LEU HB3 H 1 1.49 0.02 . 2 . . . . 51 LEU HB3 . 16521 1 666 . 1 1 51 51 LEU HD11 H 1 0.99 0.02 . 1 . . . . 51 LEU HD1 . 16521 1 667 . 1 1 51 51 LEU HD12 H 1 0.99 0.02 . 1 . . . . 51 LEU HD1 . 16521 1 668 . 1 1 51 51 LEU HD13 H 1 0.99 0.02 . 1 . . . . 51 LEU HD1 . 16521 1 669 . 1 1 51 51 LEU HD21 H 1 0.94 0.02 . 1 . . . . 51 LEU HD2 . 16521 1 670 . 1 1 51 51 LEU HD22 H 1 0.94 0.02 . 1 . . . . 51 LEU HD2 . 16521 1 671 . 1 1 51 51 LEU HD23 H 1 0.94 0.02 . 1 . . . . 51 LEU HD2 . 16521 1 672 . 1 1 51 51 LEU HG H 1 1.71 0.02 . 1 . . . . 51 LEU HG . 16521 1 673 . 1 1 51 51 LEU C C 13 176.8 0.2 . 1 . . . . 51 LEU C . 16521 1 674 . 1 1 51 51 LEU CA C 13 53.2 0.2 . 1 . . . . 51 LEU CA . 16521 1 675 . 1 1 51 51 LEU CB C 13 43.3 0.2 . 1 . . . . 51 LEU CB . 16521 1 676 . 1 1 51 51 LEU CD1 C 13 25.2 0.2 . 1 . . . . 51 LEU CD1 . 16521 1 677 . 1 1 51 51 LEU CD2 C 13 23.4 0.2 . 1 . . . . 51 LEU CD2 . 16521 1 678 . 1 1 51 51 LEU CG C 13 27.2 0.2 . 1 . . . . 51 LEU CG . 16521 1 679 . 1 1 51 51 LEU N N 15 117.6 0.2 . 1 . . . . 51 LEU N . 16521 1 680 . 1 1 52 52 GLU H H 1 8.36 0.02 . 1 . . . . 52 GLU H . 16521 1 681 . 1 1 52 52 GLU HA H 1 2.48 0.02 . 1 . . . . 52 GLU HA . 16521 1 682 . 1 1 52 52 GLU HB2 H 1 1.09 0.02 . 2 . . . . 52 GLU HB2 . 16521 1 683 . 1 1 52 52 GLU HB3 H 1 0.99 0.02 . 2 . . . . 52 GLU HB3 . 16521 1 684 . 1 1 52 52 GLU HG2 H 1 1.38 0.02 . 2 . . . . 52 GLU HG2 . 16521 1 685 . 1 1 52 52 GLU HG3 H 1 0.96 0.02 . 2 . . . . 52 GLU HG3 . 16521 1 686 . 1 1 52 52 GLU C C 13 177.8 0.2 . 1 . . . . 52 GLU C . 16521 1 687 . 1 1 52 52 GLU CA C 13 59.5 0.2 . 1 . . . . 52 GLU CA . 16521 1 688 . 1 1 52 52 GLU CB C 13 29.6 0.2 . 1 . . . . 52 GLU CB . 16521 1 689 . 1 1 52 52 GLU CG C 13 35.3 0.2 . 1 . . . . 52 GLU CG . 16521 1 690 . 1 1 52 52 GLU N N 15 127.2 0.2 . 1 . . . . 52 GLU N . 16521 1 691 . 1 1 53 53 ALA H H 1 8.39 0.02 . 1 . . . . 53 ALA H . 16521 1 692 . 1 1 53 53 ALA HA H 1 4 0.02 . 1 . . . . 53 ALA HA . 16521 1 693 . 1 1 53 53 ALA HB1 H 1 1.3 0.02 . 1 . . . . 53 ALA HB . 16521 1 694 . 1 1 53 53 ALA HB2 H 1 1.3 0.02 . 1 . . . . 53 ALA HB . 16521 1 695 . 1 1 53 53 ALA HB3 H 1 1.3 0.02 . 1 . . . . 53 ALA HB . 16521 1 696 . 1 1 53 53 ALA C C 13 180.6 0.2 . 1 . . . . 53 ALA C . 16521 1 697 . 1 1 53 53 ALA CA C 13 54.7 0.2 . 1 . . . . 53 ALA CA . 16521 1 698 . 1 1 53 53 ALA CB C 13 18.6 0.2 . 1 . . . . 53 ALA CB . 16521 1 699 . 1 1 53 53 ALA N N 15 117.9 0.2 . 1 . . . . 53 ALA N . 16521 1 700 . 1 1 54 54 ASP H H 1 6.61 0.02 . 1 . . . . 54 ASP H . 16521 1 701 . 1 1 54 54 ASP HA H 1 4.31 0.02 . 1 . . . . 54 ASP HA . 16521 1 702 . 1 1 54 54 ASP HB2 H 1 2.77 0.02 . 2 . . . . 54 ASP HB2 . 16521 1 703 . 1 1 54 54 ASP HB3 H 1 2.41 0.02 . 2 . . . . 54 ASP HB3 . 16521 1 704 . 1 1 54 54 ASP C C 13 176.8 0.2 . 1 . . . . 54 ASP C . 16521 1 705 . 1 1 54 54 ASP CA C 13 57 0.2 . 1 . . . . 54 ASP CA . 16521 1 706 . 1 1 54 54 ASP CB C 13 40.5 0.2 . 1 . . . . 54 ASP CB . 16521 1 707 . 1 1 54 54 ASP N N 15 116.2 0.2 . 1 . . . . 54 ASP N . 16521 1 708 . 1 1 55 55 ALA H H 1 6.93 0.02 . 1 . . . . 55 ALA H . 16521 1 709 . 1 1 55 55 ALA HA H 1 3.47 0.02 . 1 . . . . 55 ALA HA . 16521 1 710 . 1 1 55 55 ALA HB1 H 1 1.36 0.02 . 1 . . . . 55 ALA HB . 16521 1 711 . 1 1 55 55 ALA HB2 H 1 1.36 0.02 . 1 . . . . 55 ALA HB . 16521 1 712 . 1 1 55 55 ALA HB3 H 1 1.36 0.02 . 1 . . . . 55 ALA HB . 16521 1 713 . 1 1 55 55 ALA C C 13 179.3 0.2 . 1 . . . . 55 ALA C . 16521 1 714 . 1 1 55 55 ALA CA C 13 55.2 0.2 . 1 . . . . 55 ALA CA . 16521 1 715 . 1 1 55 55 ALA CB C 13 18.2 0.2 . 1 . . . . 55 ALA CB . 16521 1 716 . 1 1 55 55 ALA N N 15 120.1 0.2 . 1 . . . . 55 ALA N . 16521 1 717 . 1 1 56 56 GLU H H 1 8.24 0.02 . 1 . . . . 56 GLU H . 16521 1 718 . 1 1 56 56 GLU HA H 1 4.24 0.02 . 1 . . . . 56 GLU HA . 16521 1 719 . 1 1 56 56 GLU HB2 H 1 1.99 0.02 . 2 . . . . 56 GLU HB2 . 16521 1 720 . 1 1 56 56 GLU HB3 H 1 1.99 0.02 . 2 . . . . 56 GLU HB3 . 16521 1 721 . 1 1 56 56 GLU HG2 H 1 2.53 0.02 . 2 . . . . 56 GLU HG2 . 16521 1 722 . 1 1 56 56 GLU HG3 H 1 1.98 0.02 . 2 . . . . 56 GLU HG3 . 16521 1 723 . 1 1 56 56 GLU C C 13 180.2 0.2 . 1 . . . . 56 GLU C . 16521 1 724 . 1 1 56 56 GLU CA C 13 59.6 0.2 . 1 . . . . 56 GLU CA . 16521 1 725 . 1 1 56 56 GLU CB C 13 29.2 0.2 . 1 . . . . 56 GLU CB . 16521 1 726 . 1 1 56 56 GLU CG C 13 37.3 0.2 . 1 . . . . 56 GLU CG . 16521 1 727 . 1 1 56 56 GLU N N 15 116.2 0.2 . 1 . . . . 56 GLU N . 16521 1 728 . 1 1 57 57 ARG H H 1 8 0.02 . 1 . . . . 57 ARG H . 16521 1 729 . 1 1 57 57 ARG HA H 1 3.97 0.02 . 1 . . . . 57 ARG HA . 16521 1 730 . 1 1 57 57 ARG HB2 H 1 1.95 0.02 . 2 . . . . 57 ARG HB2 . 16521 1 731 . 1 1 57 57 ARG HB3 H 1 1.95 0.02 . 2 . . . . 57 ARG HB3 . 16521 1 732 . 1 1 57 57 ARG HD2 H 1 3.23 0.02 . 2 . . . . 57 ARG HD2 . 16521 1 733 . 1 1 57 57 ARG HD3 H 1 3.23 0.02 . 2 . . . . 57 ARG HD3 . 16521 1 734 . 1 1 57 57 ARG HE H 1 7.42 0.02 . 1 . . . . 57 ARG HE . 16521 1 735 . 1 1 57 57 ARG HG2 H 1 1.68 0.02 . 2 . . . . 57 ARG HG2 . 16521 1 736 . 1 1 57 57 ARG HG3 H 1 1.52 0.02 . 2 . . . . 57 ARG HG3 . 16521 1 737 . 1 1 57 57 ARG C C 13 179.9 0.2 . 1 . . . . 57 ARG C . 16521 1 738 . 1 1 57 57 ARG CA C 13 60.1 0.2 . 1 . . . . 57 ARG CA . 16521 1 739 . 1 1 57 57 ARG CB C 13 29.9 0.2 . 1 . . . . 57 ARG CB . 16521 1 740 . 1 1 57 57 ARG CD C 13 43.1 0.2 . 1 . . . . 57 ARG CD . 16521 1 741 . 1 1 57 57 ARG CG C 13 27.8 0.2 . 1 . . . . 57 ARG CG . 16521 1 742 . 1 1 57 57 ARG N N 15 122.4 0.2 . 1 . . . . 57 ARG N . 16521 1 743 . 1 1 57 57 ARG NE N 15 84.8 0.2 . 1 . . . . 57 ARG NE . 16521 1 744 . 1 1 58 58 VAL H H 1 7.96 0.02 . 1 . . . . 58 VAL H . 16521 1 745 . 1 1 58 58 VAL HA H 1 3.6 0.02 . 1 . . . . 58 VAL HA . 16521 1 746 . 1 1 58 58 VAL HB H 1 1.79 0.02 . 1 . . . . 58 VAL HB . 16521 1 747 . 1 1 58 58 VAL HG11 H 1 0.8 0.02 . 1 . . . . 58 VAL HG1 . 16521 1 748 . 1 1 58 58 VAL HG12 H 1 0.8 0.02 . 1 . . . . 58 VAL HG1 . 16521 1 749 . 1 1 58 58 VAL HG13 H 1 0.8 0.02 . 1 . . . . 58 VAL HG1 . 16521 1 750 . 1 1 58 58 VAL HG21 H 1 0.82 0.02 . 1 . . . . 58 VAL HG2 . 16521 1 751 . 1 1 58 58 VAL HG22 H 1 0.82 0.02 . 1 . . . . 58 VAL HG2 . 16521 1 752 . 1 1 58 58 VAL HG23 H 1 0.82 0.02 . 1 . . . . 58 VAL HG2 . 16521 1 753 . 1 1 58 58 VAL C C 13 177.8 0.2 . 1 . . . . 58 VAL C . 16521 1 754 . 1 1 58 58 VAL CA C 13 65.9 0.2 . 1 . . . . 58 VAL CA . 16521 1 755 . 1 1 58 58 VAL CB C 13 31.7 0.2 . 1 . . . . 58 VAL CB . 16521 1 756 . 1 1 58 58 VAL CG1 C 13 21.5 0.2 . 1 . . . . 58 VAL CG1 . 16521 1 757 . 1 1 58 58 VAL CG2 C 13 22.4 0.2 . 1 . . . . 58 VAL CG2 . 16521 1 758 . 1 1 58 58 VAL N N 15 121.1 0.2 . 1 . . . . 58 VAL N . 16521 1 759 . 1 1 59 59 SER H H 1 8.41 0.02 . 1 . . . . 59 SER H . 16521 1 760 . 1 1 59 59 SER HA H 1 4.42 0.02 . 1 . . . . 59 SER HA . 16521 1 761 . 1 1 59 59 SER HB2 H 1 3.98 0.02 . 2 . . . . 59 SER HB2 . 16521 1 762 . 1 1 59 59 SER HB3 H 1 3.98 0.02 . 2 . . . . 59 SER HB3 . 16521 1 763 . 1 1 59 59 SER HG H 1 6.33 0.02 . 1 . . . . 59 SER HG . 16521 1 764 . 1 1 59 59 SER C C 13 174.7 0.2 . 1 . . . . 59 SER C . 16521 1 765 . 1 1 59 59 SER CA C 13 62.5 0.2 . 1 . . . . 59 SER CA . 16521 1 766 . 1 1 59 59 SER N N 15 119.8 0.2 . 1 . . . . 59 SER N . 16521 1 767 . 1 1 60 60 ILE H H 1 7.02 0.02 . 1 . . . . 60 ILE H . 16521 1 768 . 1 1 60 60 ILE HA H 1 3.51 0.02 . 1 . . . . 60 ILE HA . 16521 1 769 . 1 1 60 60 ILE HB H 1 1.91 0.02 . 1 . . . . 60 ILE HB . 16521 1 770 . 1 1 60 60 ILE HD11 H 1 0.91 0.02 . 1 . . . . 60 ILE HD1 . 16521 1 771 . 1 1 60 60 ILE HD12 H 1 0.91 0.02 . 1 . . . . 60 ILE HD1 . 16521 1 772 . 1 1 60 60 ILE HD13 H 1 0.91 0.02 . 1 . . . . 60 ILE HD1 . 16521 1 773 . 1 1 60 60 ILE HG12 H 1 1.87 0.02 . 2 . . . . 60 ILE HG12 . 16521 1 774 . 1 1 60 60 ILE HG13 H 1 0.75 0.02 . 2 . . . . 60 ILE HG13 . 16521 1 775 . 1 1 60 60 ILE HG21 H 1 0.77 0.02 . 1 . . . . 60 ILE HG2 . 16521 1 776 . 1 1 60 60 ILE HG22 H 1 0.77 0.02 . 1 . . . . 60 ILE HG2 . 16521 1 777 . 1 1 60 60 ILE HG23 H 1 0.77 0.02 . 1 . . . . 60 ILE HG2 . 16521 1 778 . 1 1 60 60 ILE C C 13 176.9 0.2 . 1 . . . . 60 ILE C . 16521 1 779 . 1 1 60 60 ILE CA C 13 65.3 0.2 . 1 . . . . 60 ILE CA . 16521 1 780 . 1 1 60 60 ILE CB C 13 38.2 0.2 . 1 . . . . 60 ILE CB . 16521 1 781 . 1 1 60 60 ILE CD1 C 13 13.5 0.2 . 1 . . . . 60 ILE CD1 . 16521 1 782 . 1 1 60 60 ILE CG1 C 13 29.4 0.2 . 1 . . . . 60 ILE CG1 . 16521 1 783 . 1 1 60 60 ILE CG2 C 13 17.2 0.2 . 1 . . . . 60 ILE CG2 . 16521 1 784 . 1 1 60 60 ILE N N 15 121.8 0.2 . 1 . . . . 60 ILE N . 16521 1 785 . 1 1 61 61 ALA H H 1 6.98 0.02 . 1 . . . . 61 ALA H . 16521 1 786 . 1 1 61 61 ALA HA H 1 3.85 0.02 . 1 . . . . 61 ALA HA . 16521 1 787 . 1 1 61 61 ALA HB1 H 1 1.44 0.02 . 1 . . . . 61 ALA HB . 16521 1 788 . 1 1 61 61 ALA HB2 H 1 1.44 0.02 . 1 . . . . 61 ALA HB . 16521 1 789 . 1 1 61 61 ALA HB3 H 1 1.44 0.02 . 1 . . . . 61 ALA HB . 16521 1 790 . 1 1 61 61 ALA C C 13 181.1 0.2 . 1 . . . . 61 ALA C . 16521 1 791 . 1 1 61 61 ALA CA C 13 55.4 0.2 . 1 . . . . 61 ALA CA . 16521 1 792 . 1 1 61 61 ALA CB C 13 17.9 0.2 . 1 . . . . 61 ALA CB . 16521 1 793 . 1 1 61 61 ALA N N 15 122.2 0.2 . 1 . . . . 61 ALA N . 16521 1 794 . 1 1 62 62 CYS H H 1 8.6 0.02 . 1 . . . . 62 CYS H . 16521 1 795 . 1 1 62 62 CYS HA H 1 4.01 0.02 . 1 . . . . 62 CYS HA . 16521 1 796 . 1 1 62 62 CYS HB2 H 1 2.82 0.02 . 2 . . . . 62 CYS HB2 . 16521 1 797 . 1 1 62 62 CYS HB3 H 1 2.76 0.02 . 2 . . . . 62 CYS HB3 . 16521 1 798 . 1 1 62 62 CYS C C 13 176.7 0.2 . 1 . . . . 62 CYS C . 16521 1 799 . 1 1 62 62 CYS CA C 13 62.4 0.2 . 1 . . . . 62 CYS CA . 16521 1 800 . 1 1 62 62 CYS CB C 13 26.3 0.2 . 1 . . . . 62 CYS CB . 16521 1 801 . 1 1 62 62 CYS N N 15 115.7 0.2 . 1 . . . . 62 CYS N . 16521 1 802 . 1 1 63 63 ALA H H 1 7.65 0.02 . 1 . . . . 63 ALA H . 16521 1 803 . 1 1 63 63 ALA HA H 1 3.98 0.02 . 1 . . . . 63 ALA HA . 16521 1 804 . 1 1 63 63 ALA HB1 H 1 1.3 0.02 . 1 . . . . 63 ALA HB . 16521 1 805 . 1 1 63 63 ALA HB2 H 1 1.3 0.02 . 1 . . . . 63 ALA HB . 16521 1 806 . 1 1 63 63 ALA HB3 H 1 1.3 0.02 . 1 . . . . 63 ALA HB . 16521 1 807 . 1 1 63 63 ALA C C 13 178.9 0.2 . 1 . . . . 63 ALA C . 16521 1 808 . 1 1 63 63 ALA CA C 13 55.1 0.2 . 1 . . . . 63 ALA CA . 16521 1 809 . 1 1 63 63 ALA CB C 13 19.2 0.2 . 1 . . . . 63 ALA CB . 16521 1 810 . 1 1 63 63 ALA N N 15 123.4 0.2 . 1 . . . . 63 ALA N . 16521 1 811 . 1 1 64 64 LYS H H 1 7.99 0.02 . 1 . . . . 64 LYS H . 16521 1 812 . 1 1 64 64 LYS HA H 1 3.59 0.02 . 1 . . . . 64 LYS HA . 16521 1 813 . 1 1 64 64 LYS HB2 H 1 1.58 0.02 . 2 . . . . 64 LYS HB2 . 16521 1 814 . 1 1 64 64 LYS HB3 H 1 1.29 0.02 . 2 . . . . 64 LYS HB3 . 16521 1 815 . 1 1 64 64 LYS HD2 H 1 1.17 0.02 . 2 . . . . 64 LYS HD2 . 16521 1 816 . 1 1 64 64 LYS HD3 H 1 0.92 0.02 . 2 . . . . 64 LYS HD3 . 16521 1 817 . 1 1 64 64 LYS HE2 H 1 2.38 0.02 . 2 . . . . 64 LYS HE2 . 16521 1 818 . 1 1 64 64 LYS HE3 H 1 2.2 0.02 . 2 . . . . 64 LYS HE3 . 16521 1 819 . 1 1 64 64 LYS HG2 H 1 1.21 0.02 . 2 . . . . 64 LYS HG2 . 16521 1 820 . 1 1 64 64 LYS HG3 H 1 -0.31 0.02 . 2 . . . . 64 LYS HG3 . 16521 1 821 . 1 1 64 64 LYS C C 13 177.6 0.2 . 1 . . . . 64 LYS C . 16521 1 822 . 1 1 64 64 LYS CA C 13 60.8 0.2 . 1 . . . . 64 LYS CA . 16521 1 823 . 1 1 64 64 LYS CB C 13 32.4 0.2 . 1 . . . . 64 LYS CB . 16521 1 824 . 1 1 64 64 LYS CD C 13 29.8 0.2 . 1 . . . . 64 LYS CD . 16521 1 825 . 1 1 64 64 LYS CE C 13 41.6 0.2 . 1 . . . . 64 LYS CE . 16521 1 826 . 1 1 64 64 LYS CG C 13 25.8 0.2 . 1 . . . . 64 LYS CG . 16521 1 827 . 1 1 64 64 LYS N N 15 116.7 0.2 . 1 . . . . 64 LYS N . 16521 1 828 . 1 1 65 65 ILE H H 1 7.1 0.02 . 1 . . . . 65 ILE H . 16521 1 829 . 1 1 65 65 ILE HA H 1 3.79 0.02 . 1 . . . . 65 ILE HA . 16521 1 830 . 1 1 65 65 ILE HB H 1 1.99 0.02 . 1 . . . . 65 ILE HB . 16521 1 831 . 1 1 65 65 ILE HD11 H 1 0.84 0.02 . 1 . . . . 65 ILE HD1 . 16521 1 832 . 1 1 65 65 ILE HD12 H 1 0.84 0.02 . 1 . . . . 65 ILE HD1 . 16521 1 833 . 1 1 65 65 ILE HD13 H 1 0.84 0.02 . 1 . . . . 65 ILE HD1 . 16521 1 834 . 1 1 65 65 ILE HG12 H 1 1.71 0.02 . 2 . . . . 65 ILE HG12 . 16521 1 835 . 1 1 65 65 ILE HG13 H 1 1.21 0.02 . 2 . . . . 65 ILE HG13 . 16521 1 836 . 1 1 65 65 ILE HG21 H 1 0.97 0.02 . 1 . . . . 65 ILE HG2 . 16521 1 837 . 1 1 65 65 ILE HG22 H 1 0.97 0.02 . 1 . . . . 65 ILE HG2 . 16521 1 838 . 1 1 65 65 ILE HG23 H 1 0.97 0.02 . 1 . . . . 65 ILE HG2 . 16521 1 839 . 1 1 65 65 ILE C C 13 179 0.2 . 1 . . . . 65 ILE C . 16521 1 840 . 1 1 65 65 ILE CA C 13 64.9 0.2 . 1 . . . . 65 ILE CA . 16521 1 841 . 1 1 65 65 ILE CB C 13 38 0.2 . 1 . . . . 65 ILE CB . 16521 1 842 . 1 1 65 65 ILE CD1 C 13 13 0.2 . 1 . . . . 65 ILE CD1 . 16521 1 843 . 1 1 65 65 ILE CG1 C 13 29.1 0.2 . 1 . . . . 65 ILE CG1 . 16521 1 844 . 1 1 65 65 ILE CG2 C 13 17.2 0.2 . 1 . . . . 65 ILE CG2 . 16521 1 845 . 1 1 65 65 ILE N N 15 117.3 0.2 . 1 . . . . 65 ILE N . 16521 1 846 . 1 1 66 66 ILE H H 1 7.19 0.02 . 1 . . . . 66 ILE H . 16521 1 847 . 1 1 66 66 ILE HA H 1 3.98 0.02 . 1 . . . . 66 ILE HA . 16521 1 848 . 1 1 66 66 ILE HB H 1 2.07 0.02 . 1 . . . . 66 ILE HB . 16521 1 849 . 1 1 66 66 ILE HD11 H 1 0.82 0.02 . 1 . . . . 66 ILE HD1 . 16521 1 850 . 1 1 66 66 ILE HD12 H 1 0.82 0.02 . 1 . . . . 66 ILE HD1 . 16521 1 851 . 1 1 66 66 ILE HD13 H 1 0.82 0.02 . 1 . . . . 66 ILE HD1 . 16521 1 852 . 1 1 66 66 ILE HG12 H 1 1.53 0.02 . 2 . . . . 66 ILE HG12 . 16521 1 853 . 1 1 66 66 ILE HG13 H 1 1.53 0.02 . 2 . . . . 66 ILE HG13 . 16521 1 854 . 1 1 66 66 ILE HG21 H 1 0.81 0.02 . 1 . . . . 66 ILE HG2 . 16521 1 855 . 1 1 66 66 ILE HG22 H 1 0.81 0.02 . 1 . . . . 66 ILE HG2 . 16521 1 856 . 1 1 66 66 ILE HG23 H 1 0.81 0.02 . 1 . . . . 66 ILE HG2 . 16521 1 857 . 1 1 66 66 ILE C C 13 179.1 0.2 . 1 . . . . 66 ILE C . 16521 1 858 . 1 1 66 66 ILE CA C 13 63.2 0.2 . 1 . . . . 66 ILE CA . 16521 1 859 . 1 1 66 66 ILE CB C 13 37 0.2 . 1 . . . . 66 ILE CB . 16521 1 860 . 1 1 66 66 ILE CD1 C 13 11.6 0.2 . 1 . . . . 66 ILE CD1 . 16521 1 861 . 1 1 66 66 ILE CG1 C 13 28.2 0.2 . 1 . . . . 66 ILE CG1 . 16521 1 862 . 1 1 66 66 ILE CG2 C 13 17.3 0.2 . 1 . . . . 66 ILE CG2 . 16521 1 863 . 1 1 66 66 ILE N N 15 121 0.2 . 1 . . . . 66 ILE N . 16521 1 864 . 1 1 67 67 ILE H H 1 8.32 0.02 . 1 . . . . 67 ILE H . 16521 1 865 . 1 1 67 67 ILE HA H 1 3.47 0.02 . 1 . . . . 67 ILE HA . 16521 1 866 . 1 1 67 67 ILE HB H 1 1.92 0.02 . 1 . . . . 67 ILE HB . 16521 1 867 . 1 1 67 67 ILE HD11 H 1 0.92 0.02 . 1 . . . . 67 ILE HD1 . 16521 1 868 . 1 1 67 67 ILE HD12 H 1 0.92 0.02 . 1 . . . . 67 ILE HD1 . 16521 1 869 . 1 1 67 67 ILE HD13 H 1 0.92 0.02 . 1 . . . . 67 ILE HD1 . 16521 1 870 . 1 1 67 67 ILE HG12 H 1 1.52 0.02 . 2 . . . . 67 ILE HG12 . 16521 1 871 . 1 1 67 67 ILE HG13 H 1 0.24 0.02 . 2 . . . . 67 ILE HG13 . 16521 1 872 . 1 1 67 67 ILE HG21 H 1 1 0.02 . 1 . . . . 67 ILE HG2 . 16521 1 873 . 1 1 67 67 ILE HG22 H 1 1 0.02 . 1 . . . . 67 ILE HG2 . 16521 1 874 . 1 1 67 67 ILE HG23 H 1 1 0.02 . 1 . . . . 67 ILE HG2 . 16521 1 875 . 1 1 67 67 ILE C C 13 177.3 0.2 . 1 . . . . 67 ILE C . 16521 1 876 . 1 1 67 67 ILE CA C 13 65.7 0.2 . 1 . . . . 67 ILE CA . 16521 1 877 . 1 1 67 67 ILE CB C 13 38.6 0.2 . 1 . . . . 67 ILE CB . 16521 1 878 . 1 1 67 67 ILE CD1 C 13 16.2 0.2 . 1 . . . . 67 ILE CD1 . 16521 1 879 . 1 1 67 67 ILE CG1 C 13 30.1 0.2 . 1 . . . . 67 ILE CG1 . 16521 1 880 . 1 1 67 67 ILE CG2 C 13 19.3 0.2 . 1 . . . . 67 ILE CG2 . 16521 1 881 . 1 1 67 67 ILE N N 15 123.9 0.2 . 1 . . . . 67 ILE N . 16521 1 882 . 1 1 68 68 ASP H H 1 8.97 0.02 . 1 . . . . 68 ASP H . 16521 1 883 . 1 1 68 68 ASP HA H 1 4.35 0.02 . 1 . . . . 68 ASP HA . 16521 1 884 . 1 1 68 68 ASP HB2 H 1 2.96 0.02 . 2 . . . . 68 ASP HB2 . 16521 1 885 . 1 1 68 68 ASP HB3 H 1 2.79 0.02 . 2 . . . . 68 ASP HB3 . 16521 1 886 . 1 1 68 68 ASP C C 13 178.5 0.2 . 1 . . . . 68 ASP C . 16521 1 887 . 1 1 68 68 ASP CA C 13 57.5 0.2 . 1 . . . . 68 ASP CA . 16521 1 888 . 1 1 68 68 ASP CB C 13 39.8 0.2 . 1 . . . . 68 ASP CB . 16521 1 889 . 1 1 68 68 ASP N N 15 119.6 0.2 . 1 . . . . 68 ASP N . 16521 1 890 . 1 1 69 69 SER H H 1 8.43 0.02 . 1 . . . . 69 SER H . 16521 1 891 . 1 1 69 69 SER HA H 1 4.01 0.02 . 1 . . . . 69 SER HA . 16521 1 892 . 1 1 69 69 SER HB2 H 1 3.88 0.02 . 2 . . . . 69 SER HB2 . 16521 1 893 . 1 1 69 69 SER HB3 H 1 3.68 0.02 . 2 . . . . 69 SER HB3 . 16521 1 894 . 1 1 69 69 SER C C 13 177.3 0.2 . 1 . . . . 69 SER C . 16521 1 895 . 1 1 69 69 SER CA C 13 62.5 0.2 . 1 . . . . 69 SER CA . 16521 1 896 . 1 1 69 69 SER CB C 13 66.6 0.2 . 1 . . . . 69 SER CB . 16521 1 897 . 1 1 69 69 SER N N 15 115.7 0.2 . 1 . . . . 69 SER N . 16521 1 898 . 1 1 70 70 HIS H H 1 8.03 0.02 . 1 . . . . 70 HIS H . 16521 1 899 . 1 1 70 70 HIS HA H 1 4.49 0.02 . 1 . . . . 70 HIS HA . 16521 1 900 . 1 1 70 70 HIS HB2 H 1 3.2 0.02 . 2 . . . . 70 HIS HB2 . 16521 1 901 . 1 1 70 70 HIS HB3 H 1 3.2 0.02 . 2 . . . . 70 HIS HB3 . 16521 1 902 . 1 1 70 70 HIS HD2 H 1 6.82 0.02 . 1 . . . . 70 HIS HD2 . 16521 1 903 . 1 1 70 70 HIS HE1 H 1 7.86 0.02 . 1 . . . . 70 HIS HE1 . 16521 1 904 . 1 1 70 70 HIS C C 13 178.7 0.2 . 1 . . . . 70 HIS C . 16521 1 905 . 1 1 70 70 HIS CA C 13 61 0.2 . 1 . . . . 70 HIS CA . 16521 1 906 . 1 1 70 70 HIS CB C 13 31.6 0.2 . 1 . . . . 70 HIS CB . 16521 1 907 . 1 1 70 70 HIS CD2 C 13 118.9 0.2 . 1 . . . . 70 HIS CD2 . 16521 1 908 . 1 1 70 70 HIS CE1 C 13 139.7 0.2 . 1 . . . . 70 HIS CE1 . 16521 1 909 . 1 1 70 70 HIS N N 15 123.5 0.2 . 1 . . . . 70 HIS N . 16521 1 910 . 1 1 71 71 LEU H H 1 8.41 0.02 . 1 . . . . 71 LEU H . 16521 1 911 . 1 1 71 71 LEU HA H 1 4.06 0.02 . 1 . . . . 71 LEU HA . 16521 1 912 . 1 1 71 71 LEU HB2 H 1 1.82 0.02 . 2 . . . . 71 LEU HB2 . 16521 1 913 . 1 1 71 71 LEU HB3 H 1 1.42 0.02 . 2 . . . . 71 LEU HB3 . 16521 1 914 . 1 1 71 71 LEU HD11 H 1 1.09 0.02 . 1 . . . . 71 LEU HD1 . 16521 1 915 . 1 1 71 71 LEU HD12 H 1 1.09 0.02 . 1 . . . . 71 LEU HD1 . 16521 1 916 . 1 1 71 71 LEU HD13 H 1 1.09 0.02 . 1 . . . . 71 LEU HD1 . 16521 1 917 . 1 1 71 71 LEU HD21 H 1 1.21 0.02 . 1 . . . . 71 LEU HD2 . 16521 1 918 . 1 1 71 71 LEU HD22 H 1 1.21 0.02 . 1 . . . . 71 LEU HD2 . 16521 1 919 . 1 1 71 71 LEU HD23 H 1 1.21 0.02 . 1 . . . . 71 LEU HD2 . 16521 1 920 . 1 1 71 71 LEU HG H 1 2.05 0.02 . 1 . . . . 71 LEU HG . 16521 1 921 . 1 1 71 71 LEU C C 13 178.4 0.2 . 1 . . . . 71 LEU C . 16521 1 922 . 1 1 71 71 LEU CA C 13 57.2 0.2 . 1 . . . . 71 LEU CA . 16521 1 923 . 1 1 71 71 LEU CB C 13 43.2 0.2 . 1 . . . . 71 LEU CB . 16521 1 924 . 1 1 71 71 LEU CD1 C 13 27.4 0.2 . 1 . . . . 71 LEU CD1 . 16521 1 925 . 1 1 71 71 LEU CD2 C 13 22.7 0.2 . 1 . . . . 71 LEU CD2 . 16521 1 926 . 1 1 71 71 LEU CG C 13 27.4 0.2 . 1 . . . . 71 LEU CG . 16521 1 927 . 1 1 71 71 LEU N N 15 117.6 0.2 . 1 . . . . 71 LEU N . 16521 1 928 . 1 1 72 72 ASP H H 1 9.11 0.02 . 1 . . . . 72 ASP H . 16521 1 929 . 1 1 72 72 ASP HA H 1 4.69 0.02 . 1 . . . . 72 ASP HA . 16521 1 930 . 1 1 72 72 ASP HB2 H 1 2.81 0.02 . 2 . . . . 72 ASP HB2 . 16521 1 931 . 1 1 72 72 ASP HB3 H 1 2.67 0.02 . 2 . . . . 72 ASP HB3 . 16521 1 932 . 1 1 72 72 ASP C C 13 177.7 0.2 . 1 . . . . 72 ASP C . 16521 1 933 . 1 1 72 72 ASP CA C 13 55.4 0.2 . 1 . . . . 72 ASP CA . 16521 1 934 . 1 1 72 72 ASP CB C 13 40.6 0.2 . 1 . . . . 72 ASP CB . 16521 1 935 . 1 1 72 72 ASP N N 15 115.4 0.2 . 1 . . . . 72 ASP N . 16521 1 936 . 1 1 73 73 ARG H H 1 7.32 0.02 . 1 . . . . 73 ARG H . 16521 1 937 . 1 1 73 73 ARG HA H 1 4.5 0.02 . 1 . . . . 73 ARG HA . 16521 1 938 . 1 1 73 73 ARG HB2 H 1 2.1 0.02 . 2 . . . . 73 ARG HB2 . 16521 1 939 . 1 1 73 73 ARG HB3 H 1 2.07 0.02 . 2 . . . . 73 ARG HB3 . 16521 1 940 . 1 1 73 73 ARG HD2 H 1 3.23 0.02 . 2 . . . . 73 ARG HD2 . 16521 1 941 . 1 1 73 73 ARG HD3 H 1 3.23 0.02 . 2 . . . . 73 ARG HD3 . 16521 1 942 . 1 1 73 73 ARG HG2 H 1 1.6 0.02 . 2 . . . . 73 ARG HG2 . 16521 1 943 . 1 1 73 73 ARG HG3 H 1 1.6 0.02 . 2 . . . . 73 ARG HG3 . 16521 1 944 . 1 1 73 73 ARG CA C 13 55.4 0.2 . 1 . . . . 73 ARG CA . 16521 1 945 . 1 1 73 73 ARG CB C 13 29.7 0.2 . 1 . . . . 73 ARG CB . 16521 1 946 . 1 1 73 73 ARG CD C 13 43.3 0.2 . 1 . . . . 73 ARG CD . 16521 1 947 . 1 1 73 73 ARG CG C 13 27.8 0.2 . 1 . . . . 73 ARG CG . 16521 1 948 . 1 1 73 73 ARG N N 15 115.7 0.2 . 1 . . . . 73 ARG N . 16521 1 949 . 1 1 74 74 HIS HA H 1 4.56 0.02 . 1 . . . . 74 HIS HA . 16521 1 950 . 1 1 74 74 HIS HB2 H 1 3.26 0.02 . 2 . . . . 74 HIS HB2 . 16521 1 951 . 1 1 74 74 HIS HB3 H 1 3.26 0.02 . 2 . . . . 74 HIS HB3 . 16521 1 952 . 1 1 74 74 HIS HD2 H 1 6.96 0.02 . 1 . . . . 74 HIS HD2 . 16521 1 953 . 1 1 74 74 HIS HE1 H 1 8.16 0.02 . 1 . . . . 74 HIS HE1 . 16521 1 954 . 1 1 74 74 HIS C C 13 175.9 0.2 . 1 . . . . 74 HIS C . 16521 1 955 . 1 1 74 74 HIS CA C 13 56.2 0.2 . 1 . . . . 74 HIS CA . 16521 1 956 . 1 1 74 74 HIS CB C 13 26.7 0.2 . 1 . . . . 74 HIS CB . 16521 1 957 . 1 1 74 74 HIS CD2 C 13 119.6 0.2 . 1 . . . . 74 HIS CD2 . 16521 1 958 . 1 1 74 74 HIS CE1 C 13 137.5 0.2 . 1 . . . . 74 HIS CE1 . 16521 1 959 . 1 1 74 74 HIS ND1 N 15 199.2 0.2 . 1 . . . . 74 HIS ND1 . 16521 1 960 . 1 1 74 74 HIS NE2 N 15 176.2 0.2 . 1 . . . . 74 HIS NE2 . 16521 1 961 . 1 1 75 75 ASP H H 1 7.35 0.02 . 1 . . . . 75 ASP H . 16521 1 962 . 1 1 75 75 ASP HA H 1 4.42 0.02 . 1 . . . . 75 ASP HA . 16521 1 963 . 1 1 75 75 ASP HB2 H 1 3.12 0.02 . 2 . . . . 75 ASP HB2 . 16521 1 964 . 1 1 75 75 ASP HB3 H 1 2.31 0.02 . 2 . . . . 75 ASP HB3 . 16521 1 965 . 1 1 75 75 ASP C C 13 177.2 0.2 . 1 . . . . 75 ASP C . 16521 1 966 . 1 1 75 75 ASP CA C 13 54.3 0.2 . 1 . . . . 75 ASP CA . 16521 1 967 . 1 1 75 75 ASP CB C 13 40.7 0.2 . 1 . . . . 75 ASP CB . 16521 1 968 . 1 1 75 75 ASP N N 15 116.3 0.2 . 1 . . . . 75 ASP N . 16521 1 969 . 1 1 76 76 GLN H H 1 8.76 0.02 . 1 . . . . 76 GLN H . 16521 1 970 . 1 1 76 76 GLN HA H 1 4.26 0.02 . 1 . . . . 76 GLN HA . 16521 1 971 . 1 1 76 76 GLN HB2 H 1 2.46 0.02 . 2 . . . . 76 GLN HB2 . 16521 1 972 . 1 1 76 76 GLN HB3 H 1 2.4 0.02 . 2 . . . . 76 GLN HB3 . 16521 1 973 . 1 1 76 76 GLN HE21 H 1 7.48 0.02 . 2 . . . . 76 GLN HE21 . 16521 1 974 . 1 1 76 76 GLN HE22 H 1 6.86 0.02 . 2 . . . . 76 GLN HE22 . 16521 1 975 . 1 1 76 76 GLN HG2 H 1 2.38 0.02 . 2 . . . . 76 GLN HG2 . 16521 1 976 . 1 1 76 76 GLN HG3 H 1 2.21 0.02 . 2 . . . . 76 GLN HG3 . 16521 1 977 . 1 1 76 76 GLN C C 13 178.2 0.2 . 1 . . . . 76 GLN C . 16521 1 978 . 1 1 76 76 GLN CA C 13 57.1 0.2 . 1 . . . . 76 GLN CA . 16521 1 979 . 1 1 76 76 GLN CB C 13 26.9 0.2 . 1 . . . . 76 GLN CB . 16521 1 980 . 1 1 76 76 GLN CD C 13 181.2 0.2 . 1 . . . . 76 GLN CD . 16521 1 981 . 1 1 76 76 GLN CG C 13 33.4 0.2 . 1 . . . . 76 GLN CG . 16521 1 982 . 1 1 76 76 GLN N N 15 113.2 0.2 . 1 . . . . 76 GLN N . 16521 1 983 . 1 1 76 76 GLN NE2 N 15 112.6 0.2 . 1 . . . . 76 GLN NE2 . 16521 1 984 . 1 1 77 77 GLY H H 1 9.12 0.02 . 1 . . . . 77 GLY H . 16521 1 985 . 1 1 77 77 GLY HA2 H 1 4.26 0.02 . 2 . . . . 77 GLY HA2 . 16521 1 986 . 1 1 77 77 GLY HA3 H 1 3.82 0.02 . 2 . . . . 77 GLY HA3 . 16521 1 987 . 1 1 77 77 GLY C C 13 176.1 0.2 . 1 . . . . 77 GLY C . 16521 1 988 . 1 1 77 77 GLY CA C 13 47.3 0.2 . 1 . . . . 77 GLY CA . 16521 1 989 . 1 1 77 77 GLY N N 15 111 0.2 . 1 . . . . 77 GLY N . 16521 1 990 . 1 1 78 78 LEU H H 1 8.78 0.02 . 1 . . . . 78 LEU H . 16521 1 991 . 1 1 78 78 LEU HA H 1 4.57 0.02 . 1 . . . . 78 LEU HA . 16521 1 992 . 1 1 78 78 LEU HB2 H 1 1.2 0.02 . 2 . . . . 78 LEU HB2 . 16521 1 993 . 1 1 78 78 LEU HB3 H 1 -0.26 0.02 . 2 . . . . 78 LEU HB3 . 16521 1 994 . 1 1 78 78 LEU HD11 H 1 0.11 0.02 . 1 . . . . 78 LEU HD1 . 16521 1 995 . 1 1 78 78 LEU HD12 H 1 0.11 0.02 . 1 . . . . 78 LEU HD1 . 16521 1 996 . 1 1 78 78 LEU HD13 H 1 0.11 0.02 . 1 . . . . 78 LEU HD1 . 16521 1 997 . 1 1 78 78 LEU HD21 H 1 0.54 0.02 . 1 . . . . 78 LEU HD2 . 16521 1 998 . 1 1 78 78 LEU HD22 H 1 0.54 0.02 . 1 . . . . 78 LEU HD2 . 16521 1 999 . 1 1 78 78 LEU HD23 H 1 0.54 0.02 . 1 . . . . 78 LEU HD2 . 16521 1 1000 . 1 1 78 78 LEU HG H 1 1.15 0.02 . 1 . . . . 78 LEU HG . 16521 1 1001 . 1 1 78 78 LEU C C 13 179 0.2 . 1 . . . . 78 LEU C . 16521 1 1002 . 1 1 78 78 LEU CA C 13 52.4 0.2 . 1 . . . . 78 LEU CA . 16521 1 1003 . 1 1 78 78 LEU CB C 13 38.9 0.2 . 1 . . . . 78 LEU CB . 16521 1 1004 . 1 1 78 78 LEU CD1 C 13 26.5 0.2 . 1 . . . . 78 LEU CD1 . 16521 1 1005 . 1 1 78 78 LEU CD2 C 13 22.6 0.2 . 1 . . . . 78 LEU CD2 . 16521 1 1006 . 1 1 78 78 LEU CG C 13 32.6 0.2 . 1 . . . . 78 LEU CG . 16521 1 1007 . 1 1 78 78 LEU N N 15 117.4 0.2 . 1 . . . . 78 LEU N . 16521 1 1008 . 1 1 79 79 ALA H H 1 7.86 0.02 . 1 . . . . 79 ALA H . 16521 1 1009 . 1 1 79 79 ALA HA H 1 4.17 0.02 . 1 . . . . 79 ALA HA . 16521 1 1010 . 1 1 79 79 ALA HB1 H 1 1.63 0.02 . 1 . . . . 79 ALA HB . 16521 1 1011 . 1 1 79 79 ALA HB2 H 1 1.63 0.02 . 1 . . . . 79 ALA HB . 16521 1 1012 . 1 1 79 79 ALA HB3 H 1 1.63 0.02 . 1 . . . . 79 ALA HB . 16521 1 1013 . 1 1 79 79 ALA C C 13 179.9 0.2 . 1 . . . . 79 ALA C . 16521 1 1014 . 1 1 79 79 ALA CA C 13 55.9 0.2 . 1 . . . . 79 ALA CA . 16521 1 1015 . 1 1 79 79 ALA CB C 13 18.9 0.2 . 1 . . . . 79 ALA CB . 16521 1 1016 . 1 1 79 79 ALA N N 15 127.1 0.2 . 1 . . . . 79 ALA N . 16521 1 1017 . 1 1 80 80 ASP H H 1 8.98 0.02 . 1 . . . . 80 ASP H . 16521 1 1018 . 1 1 80 80 ASP HA H 1 4.51 0.02 . 1 . . . . 80 ASP HA . 16521 1 1019 . 1 1 80 80 ASP HB2 H 1 2.85 0.02 . 2 . . . . 80 ASP HB2 . 16521 1 1020 . 1 1 80 80 ASP HB3 H 1 2.53 0.02 . 2 . . . . 80 ASP HB3 . 16521 1 1021 . 1 1 80 80 ASP C C 13 177.3 0.2 . 1 . . . . 80 ASP C . 16521 1 1022 . 1 1 80 80 ASP CA C 13 56.5 0.2 . 1 . . . . 80 ASP CA . 16521 1 1023 . 1 1 80 80 ASP CB C 13 40.3 0.2 . 1 . . . . 80 ASP CB . 16521 1 1024 . 1 1 80 80 ASP N N 15 116 0.2 . 1 . . . . 80 ASP N . 16521 1 1025 . 1 1 81 81 LEU H H 1 7.63 0.02 . 1 . . . . 81 LEU H . 16521 1 1026 . 1 1 81 81 LEU HA H 1 4.34 0.02 . 1 . . . . 81 LEU HA . 16521 1 1027 . 1 1 81 81 LEU HB2 H 1 2.26 0.02 . 2 . . . . 81 LEU HB2 . 16521 1 1028 . 1 1 81 81 LEU HB3 H 1 1.73 0.02 . 2 . . . . 81 LEU HB3 . 16521 1 1029 . 1 1 81 81 LEU HD11 H 1 0.96 0.02 . 1 . . . . 81 LEU HD1 . 16521 1 1030 . 1 1 81 81 LEU HD12 H 1 0.96 0.02 . 1 . . . . 81 LEU HD1 . 16521 1 1031 . 1 1 81 81 LEU HD13 H 1 0.96 0.02 . 1 . . . . 81 LEU HD1 . 16521 1 1032 . 1 1 81 81 LEU HD21 H 1 1.07 0.02 . 1 . . . . 81 LEU HD2 . 16521 1 1033 . 1 1 81 81 LEU HD22 H 1 1.07 0.02 . 1 . . . . 81 LEU HD2 . 16521 1 1034 . 1 1 81 81 LEU HD23 H 1 1.07 0.02 . 1 . . . . 81 LEU HD2 . 16521 1 1035 . 1 1 81 81 LEU HG H 1 1.58 0.02 . 1 . . . . 81 LEU HG . 16521 1 1036 . 1 1 81 81 LEU C C 13 176.1 0.2 . 1 . . . . 81 LEU C . 16521 1 1037 . 1 1 81 81 LEU CA C 13 55.2 0.2 . 1 . . . . 81 LEU CA . 16521 1 1038 . 1 1 81 81 LEU CB C 13 42.1 0.2 . 1 . . . . 81 LEU CB . 16521 1 1039 . 1 1 81 81 LEU CD1 C 13 22.7 0.2 . 1 . . . . 81 LEU CD1 . 16521 1 1040 . 1 1 81 81 LEU CD2 C 13 22.7 0.2 . 1 . . . . 81 LEU CD2 . 16521 1 1041 . 1 1 81 81 LEU CG C 13 27.3 0.2 . 1 . . . . 81 LEU CG . 16521 1 1042 . 1 1 81 81 LEU N N 15 116.7 0.2 . 1 . . . . 81 LEU N . 16521 1 1043 . 1 1 82 82 GLY H H 1 7.33 0.02 . 1 . . . . 82 GLY H . 16521 1 1044 . 1 1 82 82 GLY HA2 H 1 4.11 0.02 . 2 . . . . 82 GLY HA2 . 16521 1 1045 . 1 1 82 82 GLY HA3 H 1 3.6 0.02 . 2 . . . . 82 GLY HA3 . 16521 1 1046 . 1 1 82 82 GLY CA C 13 45.9 0.2 . 1 . . . . 82 GLY CA . 16521 1 1047 . 1 1 82 82 GLY N N 15 109.1 0.2 . 1 . . . . 82 GLY N . 16521 1 stop_ save_